data_36430 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36430 _Entry.Title ; Solution structure of The first RNA binding domain of Matrin-3 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-07-12 _Entry.Accession_date 2021-08-18 _Entry.Last_release_date 2021-08-18 _Entry.Original_release_date 2021-08-18 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.2.0.16 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Y. Muto Y. . . . 36430 2 N. Kobayashi N. . . . 36430 3 S. Yokoyama S. . . . 36430 4 RSGI 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . . . . 36430 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'PSI, Protein Structure Initiative' 'RIKEN Structural Genomics/Proteomics Initiative' RSGI 36430 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID ALS/FTD . 36430 PSI-2 . 36430 'Protein Structure Initiative' . 36430 'RIKEN Structural Genomics/Proteomics Initiative' . 36430 'RNA BINDING PROTEIN' . 36430 RRM . 36430 RSGI . 36430 'Structural Genomics' . 36430 'nuclear matrix protein' . 36430 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36430 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 425 36430 '15N chemical shifts' 89 36430 '1H chemical shifts' 696 36430 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2022-02-24 . original BMRB . 36430 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 7FBR 'BMRB Entry Tracking System' 36430 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36430 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Solution structure of The first RNA binding domain of Matrin-3 ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 F. He F. . . . 36430 1 2 K. Kuwasako K. . . . 36430 1 3 M. Takizawa M. . . . 36430 1 4 M. Takahashi M. . . . 36430 1 5 K. Tsuda K. . . . 36430 1 6 T. Nagata T. . . . 36430 1 7 S. Watanabe S. . . . 36430 1 8 A. Tanaka A. . . . 36430 1 9 N. Kobayashi N. . . . 36430 1 10 T. Kigawa T. . . . 36430 1 11 P. Guntert P. . . . 36430 1 12 M. Shirouzu M. . . . 36430 1 13 S. Yokoyama S. . . . 36430 1 14 Y. Muto Y. . . . 36430 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36430 _Assembly.ID 1 _Assembly.Name Matrin-3 _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 unit_1 1 $entity_1 A A yes . . . . . . 36430 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36430 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Matrin-3 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGQKGRVETRRVVHI MDFQRGKNLRYQLLQLVEPF GVISNHLILNKINEAFIEMA TTEDAQAAVDYYTTTPALVF GKPVRVHLSQKYKRIKSGPS SG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 102 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation S397R _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 11351.972 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 36430 1 2 . SER . 36430 1 3 . SER . 36430 1 4 . GLY . 36430 1 5 . SER . 36430 1 6 . SER . 36430 1 7 389 GLY . 36430 1 8 390 GLN . 36430 1 9 391 LYS . 36430 1 10 392 GLY . 36430 1 11 393 ARG . 36430 1 12 394 VAL . 36430 1 13 395 GLU . 36430 1 14 396 THR . 36430 1 15 397 ARG . 36430 1 16 398 ARG . 36430 1 17 399 VAL . 36430 1 18 400 VAL . 36430 1 19 401 HIS . 36430 1 20 402 ILE . 36430 1 21 403 MET . 36430 1 22 404 ASP . 36430 1 23 405 PHE . 36430 1 24 406 GLN . 36430 1 25 407 ARG . 36430 1 26 408 GLY . 36430 1 27 409 LYS . 36430 1 28 410 ASN . 36430 1 29 411 LEU . 36430 1 30 412 ARG . 36430 1 31 413 TYR . 36430 1 32 414 GLN . 36430 1 33 415 LEU . 36430 1 34 416 LEU . 36430 1 35 417 GLN . 36430 1 36 418 LEU . 36430 1 37 419 VAL . 36430 1 38 420 GLU . 36430 1 39 421 PRO . 36430 1 40 422 PHE . 36430 1 41 423 GLY . 36430 1 42 424 VAL . 36430 1 43 425 ILE . 36430 1 44 426 SER . 36430 1 45 427 ASN . 36430 1 46 428 HIS . 36430 1 47 429 LEU . 36430 1 48 430 ILE . 36430 1 49 431 LEU . 36430 1 50 432 ASN . 36430 1 51 433 LYS . 36430 1 52 434 ILE . 36430 1 53 435 ASN . 36430 1 54 436 GLU . 36430 1 55 437 ALA . 36430 1 56 438 PHE . 36430 1 57 439 ILE . 36430 1 58 440 GLU . 36430 1 59 441 MET . 36430 1 60 442 ALA . 36430 1 61 443 THR . 36430 1 62 444 THR . 36430 1 63 445 GLU . 36430 1 64 446 ASP . 36430 1 65 447 ALA . 36430 1 66 448 GLN . 36430 1 67 449 ALA . 36430 1 68 450 ALA . 36430 1 69 451 VAL . 36430 1 70 452 ASP . 36430 1 71 453 TYR . 36430 1 72 454 TYR . 36430 1 73 455 THR . 36430 1 74 456 THR . 36430 1 75 457 THR . 36430 1 76 458 PRO . 36430 1 77 459 ALA . 36430 1 78 460 LEU . 36430 1 79 461 VAL . 36430 1 80 462 PHE . 36430 1 81 463 GLY . 36430 1 82 464 LYS . 36430 1 83 465 PRO . 36430 1 84 466 VAL . 36430 1 85 467 ARG . 36430 1 86 468 VAL . 36430 1 87 469 HIS . 36430 1 88 470 LEU . 36430 1 89 471 SER . 36430 1 90 472 GLN . 36430 1 91 473 LYS . 36430 1 92 474 TYR . 36430 1 93 475 LYS . 36430 1 94 476 ARG . 36430 1 95 477 ILE . 36430 1 96 478 LYS . 36430 1 97 479 SER . 36430 1 98 480 GLY . 36430 1 99 481 PRO . 36430 1 100 482 SER . 36430 1 101 483 SER . 36430 1 102 484 GLY . 36430 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 36430 1 . SER 2 2 36430 1 . SER 3 3 36430 1 . GLY 4 4 36430 1 . SER 5 5 36430 1 . SER 6 6 36430 1 . GLY 7 7 36430 1 . GLN 8 8 36430 1 . LYS 9 9 36430 1 . GLY 10 10 36430 1 . ARG 11 11 36430 1 . VAL 12 12 36430 1 . GLU 13 13 36430 1 . THR 14 14 36430 1 . ARG 15 15 36430 1 . ARG 16 16 36430 1 . VAL 17 17 36430 1 . VAL 18 18 36430 1 . HIS 19 19 36430 1 . ILE 20 20 36430 1 . MET 21 21 36430 1 . ASP 22 22 36430 1 . PHE 23 23 36430 1 . GLN 24 24 36430 1 . ARG 25 25 36430 1 . GLY 26 26 36430 1 . LYS 27 27 36430 1 . ASN 28 28 36430 1 . LEU 29 29 36430 1 . ARG 30 30 36430 1 . TYR 31 31 36430 1 . GLN 32 32 36430 1 . LEU 33 33 36430 1 . LEU 34 34 36430 1 . GLN 35 35 36430 1 . LEU 36 36 36430 1 . VAL 37 37 36430 1 . GLU 38 38 36430 1 . PRO 39 39 36430 1 . PHE 40 40 36430 1 . GLY 41 41 36430 1 . VAL 42 42 36430 1 . ILE 43 43 36430 1 . SER 44 44 36430 1 . ASN 45 45 36430 1 . HIS 46 46 36430 1 . LEU 47 47 36430 1 . ILE 48 48 36430 1 . LEU 49 49 36430 1 . ASN 50 50 36430 1 . LYS 51 51 36430 1 . ILE 52 52 36430 1 . ASN 53 53 36430 1 . GLU 54 54 36430 1 . ALA 55 55 36430 1 . PHE 56 56 36430 1 . ILE 57 57 36430 1 . GLU 58 58 36430 1 . MET 59 59 36430 1 . ALA 60 60 36430 1 . THR 61 61 36430 1 . THR 62 62 36430 1 . GLU 63 63 36430 1 . ASP 64 64 36430 1 . ALA 65 65 36430 1 . GLN 66 66 36430 1 . ALA 67 67 36430 1 . ALA 68 68 36430 1 . VAL 69 69 36430 1 . ASP 70 70 36430 1 . TYR 71 71 36430 1 . TYR 72 72 36430 1 . THR 73 73 36430 1 . THR 74 74 36430 1 . THR 75 75 36430 1 . PRO 76 76 36430 1 . ALA 77 77 36430 1 . LEU 78 78 36430 1 . VAL 79 79 36430 1 . PHE 80 80 36430 1 . GLY 81 81 36430 1 . LYS 82 82 36430 1 . PRO 83 83 36430 1 . VAL 84 84 36430 1 . ARG 85 85 36430 1 . VAL 86 86 36430 1 . HIS 87 87 36430 1 . LEU 88 88 36430 1 . SER 89 89 36430 1 . GLN 90 90 36430 1 . LYS 91 91 36430 1 . TYR 92 92 36430 1 . LYS 93 93 36430 1 . ARG 94 94 36430 1 . ILE 95 95 36430 1 . LYS 96 96 36430 1 . SER 97 97 36430 1 . GLY 98 98 36430 1 . PRO 99 99 36430 1 . SER 100 100 36430 1 . SER 101 101 36430 1 . GLY 102 102 36430 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 36430 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . Matr3 . 36430 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 36430 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Cell-free gateway cloning vector N-term 8xHis eGFP pCellFree_G03' . . 1508207 . . . . . . . . . . . . 36430 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 36430 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.0 mM [U-99% 13C; U-99% 15N] RNA binding protein, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'RNA binding protein' '[U-99% 13C; U-99% 15N]' 1 $assembly 1 $entity_1 . protein 1.0 . . mM . . . . 36430 1 2 Tris-Hcl '[U-100% 2H]' . . . . . buffer 20 . . mM . . . . 36430 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 36430 1 4 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 36430 1 5 D2O [U-2H] . . . . . solvent 10 . . % . . . . 36430 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 36430 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 36430 1 pH 7 . pH 36430 1 pressure 1 . atm 36430 1 temperature 298 . K 36430 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36430 _Software.ID 1 _Software.Type . _Software.Name Amber _Software.Version 12 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 36430 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 36430 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36430 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 36430 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 36430 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 36430 _Software.ID 3 _Software.Type . _Software.Name KUJIRA _Software.Version 0.863 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'N. Kobayashi, T. Kigawa, S. Yokoyama' . . 36430 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 36430 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 36430 _Software.ID 4 _Software.Type . _Software.Name NMRPipe _Software.Version 2007 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 36430 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 36430 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 36430 _Software.ID 5 _Software.Type . _Software.Name NMRView _Software.Version 5.0.4 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 36430 5 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 36430 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 36430 _Software.ID 6 _Software.Type . _Software.Name TALOS _Software.Version 2007 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 36430 6 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'geometry optimization' . 36430 6 stop_ save_ save_software_7 _Software.Sf_category software _Software.Sf_framecode software_7 _Software.Entry_ID 36430 _Software.ID 7 _Software.Type . _Software.Name TopSpin _Software.Version 2.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 36430 7 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 36430 7 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 36430 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 36430 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AVANCE . 800 . . . 36430 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 36430 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D_13C,15N-SEPARATED_NOESY SPECTRA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36430 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 36430 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.821ppm at 298K) and then those of 15N and 13C were calculated based on their gyro-magnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.821 internal indirect 0.251449530 . . . . . 36430 1 H 1 water protons . . . . ppm 4.821 internal direct 1.0 . . . . . 36430 1 N 15 water protons . . . . ppm 4.821 internal indirect 0.101329118 . . . . . 36430 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 36430 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D_13C,15N-SEPARATED_NOESY SPECTRA' 1 $sample_1 isotropic 36430 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 7 7 GLY HA2 H 1 3.952 0.030 . 1 . . . . A 389 GLY HA2 . 36430 1 2 . 1 . 1 7 7 GLY HA3 H 1 3.952 0.030 . 1 . . . . A 389 GLY HA3 . 36430 1 3 . 1 . 1 7 7 GLY C C 13 174.223 0.300 . 1 . . . . A 389 GLY C . 36430 1 4 . 1 . 1 7 7 GLY CA C 13 45.393 0.300 . 1 . . . . A 389 GLY CA . 36430 1 5 . 1 . 1 8 8 GLN H H 1 8.208 0.030 . 1 . . . . A 390 GLN H . 36430 1 6 . 1 . 1 8 8 GLN HA H 1 4.302 0.030 . 1 . . . . A 390 GLN HA . 36430 1 7 . 1 . 1 8 8 GLN HB2 H 1 2.088 0.030 . 2 . . . . A 390 GLN HB2 . 36430 1 8 . 1 . 1 8 8 GLN HB3 H 1 1.957 0.030 . 2 . . . . A 390 GLN HB3 . 36430 1 9 . 1 . 1 8 8 GLN HG2 H 1 2.338 0.030 . 1 . . . . A 390 GLN HG2 . 36430 1 10 . 1 . 1 8 8 GLN HG3 H 1 2.338 0.030 . 1 . . . . A 390 GLN HG3 . 36430 1 11 . 1 . 1 8 8 GLN HE21 H 1 7.521 0.030 . 2 . . . . A 390 GLN HE21 . 36430 1 12 . 1 . 1 8 8 GLN HE22 H 1 6.850 0.030 . 2 . . . . A 390 GLN HE22 . 36430 1 13 . 1 . 1 8 8 GLN C C 13 176.162 0.300 . 1 . . . . A 390 GLN C . 36430 1 14 . 1 . 1 8 8 GLN CA C 13 55.935 0.300 . 1 . . . . A 390 GLN CA . 36430 1 15 . 1 . 1 8 8 GLN CB C 13 29.434 0.300 . 1 . . . . A 390 GLN CB . 36430 1 16 . 1 . 1 8 8 GLN CG C 13 33.767 0.300 . 1 . . . . A 390 GLN CG . 36430 1 17 . 1 . 1 8 8 GLN N N 15 119.929 0.300 . 1 . . . . A 390 GLN N . 36430 1 18 . 1 . 1 8 8 GLN NE2 N 15 112.561 0.300 . 1 . . . . A 390 GLN NE2 . 36430 1 19 . 1 . 1 9 9 LYS H H 1 8.407 0.030 . 1 . . . . A 391 LYS H . 36430 1 20 . 1 . 1 9 9 LYS HA H 1 4.286 0.030 . 1 . . . . A 391 LYS HA . 36430 1 21 . 1 . 1 9 9 LYS HB2 H 1 1.765 0.030 . 2 . . . . A 391 LYS HB2 . 36430 1 22 . 1 . 1 9 9 LYS HB3 H 1 1.846 0.030 . 2 . . . . A 391 LYS HB3 . 36430 1 23 . 1 . 1 9 9 LYS HG2 H 1 1.420 0.030 . 1 . . . . A 391 LYS HG2 . 36430 1 24 . 1 . 1 9 9 LYS HG3 H 1 1.420 0.030 . 1 . . . . A 391 LYS HG3 . 36430 1 25 . 1 . 1 9 9 LYS HD2 H 1 1.653 0.030 . 1 . . . . A 391 LYS HD2 . 36430 1 26 . 1 . 1 9 9 LYS HD3 H 1 1.653 0.030 . 1 . . . . A 391 LYS HD3 . 36430 1 27 . 1 . 1 9 9 LYS HE2 H 1 2.969 0.030 . 1 . . . . A 391 LYS HE2 . 36430 1 28 . 1 . 1 9 9 LYS HE3 H 1 2.969 0.030 . 1 . . . . A 391 LYS HE3 . 36430 1 29 . 1 . 1 9 9 LYS C C 13 177.099 0.300 . 1 . . . . A 391 LYS C . 36430 1 30 . 1 . 1 9 9 LYS CA C 13 56.616 0.300 . 1 . . . . A 391 LYS CA . 36430 1 31 . 1 . 1 9 9 LYS CB C 13 32.869 0.300 . 1 . . . . A 391 LYS CB . 36430 1 32 . 1 . 1 9 9 LYS CG C 13 24.798 0.300 . 1 . . . . A 391 LYS CG . 36430 1 33 . 1 . 1 9 9 LYS CD C 13 29.083 0.300 . 1 . . . . A 391 LYS CD . 36430 1 34 . 1 . 1 9 9 LYS CE C 13 42.139 0.300 . 1 . . . . A 391 LYS CE . 36430 1 35 . 1 . 1 9 9 LYS N N 15 122.735 0.300 . 1 . . . . A 391 LYS N . 36430 1 36 . 1 . 1 10 10 GLY H H 1 8.417 0.030 . 1 . . . . A 392 GLY H . 36430 1 37 . 1 . 1 10 10 GLY HA2 H 1 3.931 0.030 . 1 . . . . A 392 GLY HA2 . 36430 1 38 . 1 . 1 10 10 GLY HA3 H 1 3.931 0.030 . 1 . . . . A 392 GLY HA3 . 36430 1 39 . 1 . 1 10 10 GLY C C 13 173.770 0.300 . 1 . . . . A 392 GLY C . 36430 1 40 . 1 . 1 10 10 GLY CA C 13 45.151 0.300 . 1 . . . . A 392 GLY CA . 36430 1 41 . 1 . 1 10 10 GLY N N 15 110.032 0.300 . 1 . . . . A 392 GLY N . 36430 1 42 . 1 . 1 11 11 ARG H H 1 8.119 0.030 . 1 . . . . A 393 ARG H . 36430 1 43 . 1 . 1 11 11 ARG HA H 1 4.349 0.030 . 1 . . . . A 393 ARG HA . 36430 1 44 . 1 . 1 11 11 ARG HB2 H 1 1.808 0.030 . 2 . . . . A 393 ARG HB2 . 36430 1 45 . 1 . 1 11 11 ARG HB3 H 1 1.725 0.030 . 2 . . . . A 393 ARG HB3 . 36430 1 46 . 1 . 1 11 11 ARG HG2 H 1 1.599 0.030 . 2 . . . . A 393 ARG HG2 . 36430 1 47 . 1 . 1 11 11 ARG HG3 H 1 1.533 0.030 . 2 . . . . A 393 ARG HG3 . 36430 1 48 . 1 . 1 11 11 ARG HD2 H 1 3.172 0.030 . 1 . . . . A 393 ARG HD2 . 36430 1 49 . 1 . 1 11 11 ARG HD3 H 1 3.172 0.030 . 1 . . . . A 393 ARG HD3 . 36430 1 50 . 1 . 1 11 11 ARG C C 13 176.123 0.300 . 1 . . . . A 393 ARG C . 36430 1 51 . 1 . 1 11 11 ARG CA C 13 56.030 0.300 . 1 . . . . A 393 ARG CA . 36430 1 52 . 1 . 1 11 11 ARG CB C 13 31.027 0.300 . 1 . . . . A 393 ARG CB . 36430 1 53 . 1 . 1 11 11 ARG CG C 13 27.028 0.300 . 1 . . . . A 393 ARG CG . 36430 1 54 . 1 . 1 11 11 ARG CD C 13 43.435 0.300 . 1 . . . . A 393 ARG CD . 36430 1 55 . 1 . 1 11 11 ARG N N 15 120.899 0.300 . 1 . . . . A 393 ARG N . 36430 1 56 . 1 . 1 12 12 VAL H H 1 8.220 0.030 . 1 . . . . A 394 VAL H . 36430 1 57 . 1 . 1 12 12 VAL HA H 1 4.101 0.030 . 1 . . . . A 394 VAL HA . 36430 1 58 . 1 . 1 12 12 VAL HB H 1 2.021 0.030 . 1 . . . . A 394 VAL HB . 36430 1 59 . 1 . 1 12 12 VAL HG11 H 1 0.911 0.030 . 2 . . . . A 394 VAL HG11 . 36430 1 60 . 1 . 1 12 12 VAL HG12 H 1 0.911 0.030 . 2 . . . . A 394 VAL HG12 . 36430 1 61 . 1 . 1 12 12 VAL HG13 H 1 0.911 0.030 . 2 . . . . A 394 VAL HG13 . 36430 1 62 . 1 . 1 12 12 VAL HG21 H 1 0.890 0.030 . 2 . . . . A 394 VAL HG21 . 36430 1 63 . 1 . 1 12 12 VAL HG22 H 1 0.890 0.030 . 2 . . . . A 394 VAL HG22 . 36430 1 64 . 1 . 1 12 12 VAL HG23 H 1 0.890 0.030 . 2 . . . . A 394 VAL HG23 . 36430 1 65 . 1 . 1 12 12 VAL C C 13 175.612 0.300 . 1 . . . . A 394 VAL C . 36430 1 66 . 1 . 1 12 12 VAL CA C 13 62.078 0.300 . 1 . . . . A 394 VAL CA . 36430 1 67 . 1 . 1 12 12 VAL CB C 13 32.947 0.300 . 1 . . . . A 394 VAL CB . 36430 1 68 . 1 . 1 12 12 VAL CG1 C 13 20.605 0.300 . 2 . . . . A 394 VAL CG1 . 36430 1 69 . 1 . 1 12 12 VAL CG2 C 13 21.125 0.300 . 2 . . . . A 394 VAL CG2 . 36430 1 70 . 1 . 1 12 12 VAL N N 15 122.469 0.300 . 1 . . . . A 394 VAL N . 36430 1 71 . 1 . 1 13 13 GLU H H 1 8.573 0.030 . 1 . . . . A 395 GLU H . 36430 1 72 . 1 . 1 13 13 GLU HA H 1 4.296 0.030 . 1 . . . . A 395 GLU HA . 36430 1 73 . 1 . 1 13 13 GLU HB2 H 1 1.967 0.030 . 1 . . . . A 395 GLU HB2 . 36430 1 74 . 1 . 1 13 13 GLU HB3 H 1 1.967 0.030 . 1 . . . . A 395 GLU HB3 . 36430 1 75 . 1 . 1 13 13 GLU HG2 H 1 2.160 0.030 . 1 . . . . A 395 GLU HG2 . 36430 1 76 . 1 . 1 13 13 GLU HG3 H 1 2.160 0.030 . 1 . . . . A 395 GLU HG3 . 36430 1 77 . 1 . 1 13 13 GLU C C 13 175.627 0.300 . 1 . . . . A 395 GLU C . 36430 1 78 . 1 . 1 13 13 GLU CA C 13 56.067 0.300 . 1 . . . . A 395 GLU CA . 36430 1 79 . 1 . 1 13 13 GLU CB C 13 30.895 0.300 . 1 . . . . A 395 GLU CB . 36430 1 80 . 1 . 1 13 13 GLU CG C 13 36.880 0.300 . 1 . . . . A 395 GLU CG . 36430 1 81 . 1 . 1 13 13 GLU N N 15 126.697 0.300 . 1 . . . . A 395 GLU N . 36430 1 82 . 1 . 1 14 14 THR H H 1 8.054 0.030 . 1 . . . . A 396 THR H . 36430 1 83 . 1 . 1 14 14 THR HA H 1 4.498 0.030 . 1 . . . . A 396 THR HA . 36430 1 84 . 1 . 1 14 14 THR HB H 1 4.350 0.030 . 1 . . . . A 396 THR HB . 36430 1 85 . 1 . 1 14 14 THR HG21 H 1 1.183 0.030 . 1 . . . . A 396 THR HG21 . 36430 1 86 . 1 . 1 14 14 THR HG22 H 1 1.183 0.030 . 1 . . . . A 396 THR HG22 . 36430 1 87 . 1 . 1 14 14 THR HG23 H 1 1.183 0.030 . 1 . . . . A 396 THR HG23 . 36430 1 88 . 1 . 1 14 14 THR C C 13 175.532 0.300 . 1 . . . . A 396 THR C . 36430 1 89 . 1 . 1 14 14 THR CA C 13 61.121 0.300 . 1 . . . . A 396 THR CA . 36430 1 90 . 1 . 1 14 14 THR CB C 13 70.858 0.300 . 1 . . . . A 396 THR CB . 36430 1 91 . 1 . 1 14 14 THR CG2 C 13 21.808 0.300 . 1 . . . . A 396 THR CG2 . 36430 1 92 . 1 . 1 14 14 THR N N 15 114.897 0.300 . 1 . . . . A 396 THR N . 36430 1 93 . 1 . 1 15 15 ARG H H 1 8.962 0.030 . 1 . . . . A 397 ARG H . 36430 1 94 . 1 . 1 15 15 ARG HA H 1 4.291 0.030 . 1 . . . . A 397 ARG HA . 36430 1 95 . 1 . 1 15 15 ARG HB2 H 1 1.878 0.030 . 2 . . . . A 397 ARG HB2 . 36430 1 96 . 1 . 1 15 15 ARG HB3 H 1 1.960 0.030 . 2 . . . . A 397 ARG HB3 . 36430 1 97 . 1 . 1 15 15 ARG HG2 H 1 1.673 0.030 . 2 . . . . A 397 ARG HG2 . 36430 1 98 . 1 . 1 15 15 ARG HG3 H 1 1.860 0.030 . 2 . . . . A 397 ARG HG3 . 36430 1 99 . 1 . 1 15 15 ARG HD2 H 1 3.281 0.030 . 2 . . . . A 397 ARG HD2 . 36430 1 100 . 1 . 1 15 15 ARG HD3 H 1 2.930 0.030 . 2 . . . . A 397 ARG HD3 . 36430 1 101 . 1 . 1 15 15 ARG C C 13 177.130 0.300 . 1 . . . . A 397 ARG C . 36430 1 102 . 1 . 1 15 15 ARG CA C 13 58.083 0.300 . 1 . . . . A 397 ARG CA . 36430 1 103 . 1 . 1 15 15 ARG CB C 13 31.127 0.300 . 1 . . . . A 397 ARG CB . 36430 1 104 . 1 . 1 15 15 ARG CG C 13 27.433 0.300 . 1 . . . . A 397 ARG CG . 36430 1 105 . 1 . 1 15 15 ARG CD C 13 43.650 0.300 . 1 . . . . A 397 ARG CD . 36430 1 106 . 1 . 1 15 15 ARG N N 15 123.413 0.300 . 1 . . . . A 397 ARG N . 36430 1 107 . 1 . 1 16 16 ARG H H 1 8.551 0.030 . 1 . . . . A 398 ARG H . 36430 1 108 . 1 . 1 16 16 ARG HA H 1 4.482 0.030 . 1 . . . . A 398 ARG HA . 36430 1 109 . 1 . 1 16 16 ARG HB2 H 1 1.734 0.030 . 2 . . . . A 398 ARG HB2 . 36430 1 110 . 1 . 1 16 16 ARG HB3 H 1 2.181 0.030 . 2 . . . . A 398 ARG HB3 . 36430 1 111 . 1 . 1 16 16 ARG HG2 H 1 1.276 0.030 . 2 . . . . A 398 ARG HG2 . 36430 1 112 . 1 . 1 16 16 ARG HG3 H 1 1.699 0.030 . 2 . . . . A 398 ARG HG3 . 36430 1 113 . 1 . 1 16 16 ARG HD2 H 1 3.146 0.030 . 2 . . . . A 398 ARG HD2 . 36430 1 114 . 1 . 1 16 16 ARG HD3 H 1 3.081 0.030 . 2 . . . . A 398 ARG HD3 . 36430 1 115 . 1 . 1 16 16 ARG C C 13 174.024 0.300 . 1 . . . . A 398 ARG C . 36430 1 116 . 1 . 1 16 16 ARG CA C 13 55.597 0.300 . 1 . . . . A 398 ARG CA . 36430 1 117 . 1 . 1 16 16 ARG CB C 13 32.341 0.300 . 1 . . . . A 398 ARG CB . 36430 1 118 . 1 . 1 16 16 ARG CG C 13 27.326 0.300 . 1 . . . . A 398 ARG CG . 36430 1 119 . 1 . 1 16 16 ARG CD C 13 44.152 0.300 . 1 . . . . A 398 ARG CD . 36430 1 120 . 1 . 1 16 16 ARG N N 15 118.901 0.300 . 1 . . . . A 398 ARG N . 36430 1 121 . 1 . 1 17 17 VAL HA H 1 4.671 0.030 . 1 . . . . A 399 VAL HA . 36430 1 122 . 1 . 1 17 17 VAL HB H 1 2.233 0.030 . 1 . . . . A 399 VAL HB . 36430 1 123 . 1 . 1 17 17 VAL HG11 H 1 0.908 0.030 . 2 . . . . A 399 VAL HG11 . 36430 1 124 . 1 . 1 17 17 VAL HG12 H 1 0.908 0.030 . 2 . . . . A 399 VAL HG12 . 36430 1 125 . 1 . 1 17 17 VAL HG13 H 1 0.908 0.030 . 2 . . . . A 399 VAL HG13 . 36430 1 126 . 1 . 1 17 17 VAL HG21 H 1 0.713 0.030 . 2 . . . . A 399 VAL HG21 . 36430 1 127 . 1 . 1 17 17 VAL HG22 H 1 0.713 0.030 . 2 . . . . A 399 VAL HG22 . 36430 1 128 . 1 . 1 17 17 VAL HG23 H 1 0.713 0.030 . 2 . . . . A 399 VAL HG23 . 36430 1 129 . 1 . 1 17 17 VAL C C 13 174.082 0.300 . 1 . . . . A 399 VAL C . 36430 1 130 . 1 . 1 17 17 VAL CA C 13 61.781 0.300 . 1 . . . . A 399 VAL CA . 36430 1 131 . 1 . 1 17 17 VAL CB C 13 31.923 0.300 . 1 . . . . A 399 VAL CB . 36430 1 132 . 1 . 1 17 17 VAL CG1 C 13 23.402 0.300 . 2 . . . . A 399 VAL CG1 . 36430 1 133 . 1 . 1 17 17 VAL CG2 C 13 22.406 0.300 . 2 . . . . A 399 VAL CG2 . 36430 1 134 . 1 . 1 18 18 VAL H H 1 9.476 0.030 . 1 . . . . A 400 VAL H . 36430 1 135 . 1 . 1 18 18 VAL HA H 1 4.216 0.030 . 1 . . . . A 400 VAL HA . 36430 1 136 . 1 . 1 18 18 VAL HB H 1 2.099 0.030 . 1 . . . . A 400 VAL HB . 36430 1 137 . 1 . 1 18 18 VAL HG11 H 1 0.950 0.030 . 2 . . . . A 400 VAL HG11 . 36430 1 138 . 1 . 1 18 18 VAL HG12 H 1 0.950 0.030 . 2 . . . . A 400 VAL HG12 . 36430 1 139 . 1 . 1 18 18 VAL HG13 H 1 0.950 0.030 . 2 . . . . A 400 VAL HG13 . 36430 1 140 . 1 . 1 18 18 VAL HG21 H 1 0.729 0.030 . 2 . . . . A 400 VAL HG21 . 36430 1 141 . 1 . 1 18 18 VAL HG22 H 1 0.729 0.030 . 2 . . . . A 400 VAL HG22 . 36430 1 142 . 1 . 1 18 18 VAL HG23 H 1 0.729 0.030 . 2 . . . . A 400 VAL HG23 . 36430 1 143 . 1 . 1 18 18 VAL C C 13 173.486 0.300 . 1 . . . . A 400 VAL C . 36430 1 144 . 1 . 1 18 18 VAL CA C 13 62.116 0.300 . 1 . . . . A 400 VAL CA . 36430 1 145 . 1 . 1 18 18 VAL CB C 13 32.612 0.300 . 1 . . . . A 400 VAL CB . 36430 1 146 . 1 . 1 18 18 VAL CG1 C 13 21.360 0.300 . 2 . . . . A 400 VAL CG1 . 36430 1 147 . 1 . 1 18 18 VAL CG2 C 13 22.045 0.300 . 2 . . . . A 400 VAL CG2 . 36430 1 148 . 1 . 1 18 18 VAL N N 15 128.894 0.300 . 1 . . . . A 400 VAL N . 36430 1 149 . 1 . 1 19 19 HIS H H 1 9.745 0.030 . 1 . . . . A 401 HIS H . 36430 1 150 . 1 . 1 19 19 HIS HA H 1 5.311 0.030 . 1 . . . . A 401 HIS HA . 36430 1 151 . 1 . 1 19 19 HIS HB2 H 1 3.149 0.030 . 2 . . . . A 401 HIS HB2 . 36430 1 152 . 1 . 1 19 19 HIS HB3 H 1 2.666 0.030 . 2 . . . . A 401 HIS HB3 . 36430 1 153 . 1 . 1 19 19 HIS HD2 H 1 6.136 0.030 . 1 . . . . A 401 HIS HD2 . 36430 1 154 . 1 . 1 19 19 HIS HE1 H 1 7.912 0.030 . 1 . . . . A 401 HIS HE1 . 36430 1 155 . 1 . 1 19 19 HIS C C 13 173.329 0.300 . 1 . . . . A 401 HIS C . 36430 1 156 . 1 . 1 19 19 HIS CA C 13 52.182 0.300 . 1 . . . . A 401 HIS CA . 36430 1 157 . 1 . 1 19 19 HIS CB C 13 34.611 0.300 . 1 . . . . A 401 HIS CB . 36430 1 158 . 1 . 1 19 19 HIS CD2 C 13 116.207 0.300 . 1 . . . . A 401 HIS CD2 . 36430 1 159 . 1 . 1 19 19 HIS CE1 C 13 139.280 0.300 . 1 . . . . A 401 HIS CE1 . 36430 1 160 . 1 . 1 19 19 HIS N N 15 131.710 0.300 . 1 . . . . A 401 HIS N . 36430 1 161 . 1 . 1 20 20 ILE H H 1 8.955 0.030 . 1 . . . . A 402 ILE H . 36430 1 162 . 1 . 1 20 20 ILE HA H 1 5.116 0.030 . 1 . . . . A 402 ILE HA . 36430 1 163 . 1 . 1 20 20 ILE HB H 1 1.451 0.030 . 1 . . . . A 402 ILE HB . 36430 1 164 . 1 . 1 20 20 ILE HG12 H 1 1.454 0.030 . 2 . . . . A 402 ILE HG12 . 36430 1 165 . 1 . 1 20 20 ILE HG13 H 1 0.888 0.030 . 2 . . . . A 402 ILE HG13 . 36430 1 166 . 1 . 1 20 20 ILE HG21 H 1 0.769 0.030 . 1 . . . . A 402 ILE HG21 . 36430 1 167 . 1 . 1 20 20 ILE HG22 H 1 0.769 0.030 . 1 . . . . A 402 ILE HG22 . 36430 1 168 . 1 . 1 20 20 ILE HG23 H 1 0.769 0.030 . 1 . . . . A 402 ILE HG23 . 36430 1 169 . 1 . 1 20 20 ILE HD11 H 1 0.632 0.030 . 1 . . . . A 402 ILE HD11 . 36430 1 170 . 1 . 1 20 20 ILE HD12 H 1 0.632 0.030 . 1 . . . . A 402 ILE HD12 . 36430 1 171 . 1 . 1 20 20 ILE HD13 H 1 0.632 0.030 . 1 . . . . A 402 ILE HD13 . 36430 1 172 . 1 . 1 20 20 ILE C C 13 175.115 0.300 . 1 . . . . A 402 ILE C . 36430 1 173 . 1 . 1 20 20 ILE CA C 13 59.448 0.300 . 1 . . . . A 402 ILE CA . 36430 1 174 . 1 . 1 20 20 ILE CB C 13 40.322 0.300 . 1 . . . . A 402 ILE CB . 36430 1 175 . 1 . 1 20 20 ILE CG1 C 13 28.135 0.300 . 1 . . . . A 402 ILE CG1 . 36430 1 176 . 1 . 1 20 20 ILE CG2 C 13 18.177 0.300 . 1 . . . . A 402 ILE CG2 . 36430 1 177 . 1 . 1 20 20 ILE CD1 C 13 14.527 0.300 . 1 . . . . A 402 ILE CD1 . 36430 1 178 . 1 . 1 20 20 ILE N N 15 126.502 0.300 . 1 . . . . A 402 ILE N . 36430 1 179 . 1 . 1 21 21 MET H H 1 8.592 0.030 . 1 . . . . A 403 MET H . 36430 1 180 . 1 . 1 21 21 MET HA H 1 4.935 0.030 . 1 . . . . A 403 MET HA . 36430 1 181 . 1 . 1 21 21 MET HB2 H 1 1.991 0.030 . 2 . . . . A 403 MET HB2 . 36430 1 182 . 1 . 1 21 21 MET HB3 H 1 1.520 0.030 . 2 . . . . A 403 MET HB3 . 36430 1 183 . 1 . 1 21 21 MET HG2 H 1 1.908 0.030 . 2 . . . . A 403 MET HG2 . 36430 1 184 . 1 . 1 21 21 MET HG3 H 1 1.512 0.030 . 2 . . . . A 403 MET HG3 . 36430 1 185 . 1 . 1 21 21 MET HE1 H 1 1.355 0.030 . 1 . . . . A 403 MET HE1 . 36430 1 186 . 1 . 1 21 21 MET HE2 H 1 1.355 0.030 . 1 . . . . A 403 MET HE2 . 36430 1 187 . 1 . 1 21 21 MET HE3 H 1 1.355 0.030 . 1 . . . . A 403 MET HE3 . 36430 1 188 . 1 . 1 21 21 MET C C 13 175.115 0.300 . 1 . . . . A 403 MET C . 36430 1 189 . 1 . 1 21 21 MET CA C 13 54.391 0.300 . 1 . . . . A 403 MET CA . 36430 1 190 . 1 . 1 21 21 MET CB C 13 38.158 0.300 . 1 . . . . A 403 MET CB . 36430 1 191 . 1 . 1 21 21 MET CG C 13 31.142 0.300 . 1 . . . . A 403 MET CG . 36430 1 192 . 1 . 1 21 21 MET CE C 13 16.730 0.300 . 1 . . . . A 403 MET CE . 36430 1 193 . 1 . 1 21 21 MET N N 15 122.967 0.300 . 1 . . . . A 403 MET N . 36430 1 194 . 1 . 1 22 22 ASP H H 1 8.042 0.030 . 1 . . . . A 404 ASP H . 36430 1 195 . 1 . 1 22 22 ASP HA H 1 4.169 0.030 . 1 . . . . A 404 ASP HA . 36430 1 196 . 1 . 1 22 22 ASP HB2 H 1 3.157 0.030 . 2 . . . . A 404 ASP HB2 . 36430 1 197 . 1 . 1 22 22 ASP HB3 H 1 3.119 0.030 . 2 . . . . A 404 ASP HB3 . 36430 1 198 . 1 . 1 22 22 ASP C C 13 175.501 0.300 . 1 . . . . A 404 ASP C . 36430 1 199 . 1 . 1 22 22 ASP CA C 13 56.341 0.300 . 1 . . . . A 404 ASP CA . 36430 1 200 . 1 . 1 22 22 ASP CB C 13 38.535 0.300 . 1 . . . . A 404 ASP CB . 36430 1 201 . 1 . 1 22 22 ASP N N 15 110.927 0.300 . 1 . . . . A 404 ASP N . 36430 1 202 . 1 . 1 23 23 PHE H H 1 6.326 0.030 . 1 . . . . A 405 PHE H . 36430 1 203 . 1 . 1 23 23 PHE HA H 1 4.591 0.030 . 1 . . . . A 405 PHE HA . 36430 1 204 . 1 . 1 23 23 PHE HB2 H 1 3.344 0.030 . 2 . . . . A 405 PHE HB2 . 36430 1 205 . 1 . 1 23 23 PHE HB3 H 1 2.519 0.030 . 2 . . . . A 405 PHE HB3 . 36430 1 206 . 1 . 1 23 23 PHE HD1 H 1 6.730 0.030 . 1 . . . . A 405 PHE HD1 . 36430 1 207 . 1 . 1 23 23 PHE HD2 H 1 6.730 0.030 . 1 . . . . A 405 PHE HD2 . 36430 1 208 . 1 . 1 23 23 PHE HE1 H 1 6.981 0.030 . 1 . . . . A 405 PHE HE1 . 36430 1 209 . 1 . 1 23 23 PHE HE2 H 1 6.981 0.030 . 1 . . . . A 405 PHE HE2 . 36430 1 210 . 1 . 1 23 23 PHE HZ H 1 7.092 0.030 . 1 . . . . A 405 PHE HZ . 36430 1 211 . 1 . 1 23 23 PHE C C 13 174.635 0.300 . 1 . . . . A 405 PHE C . 36430 1 212 . 1 . 1 23 23 PHE CA C 13 54.671 0.300 . 1 . . . . A 405 PHE CA . 36430 1 213 . 1 . 1 23 23 PHE CB C 13 39.310 0.300 . 1 . . . . A 405 PHE CB . 36430 1 214 . 1 . 1 23 23 PHE CD1 C 13 132.911 0.300 . 1 . . . . A 405 PHE CD1 . 36430 1 215 . 1 . 1 23 23 PHE CD2 C 13 132.911 0.300 . 1 . . . . A 405 PHE CD2 . 36430 1 216 . 1 . 1 23 23 PHE CE1 C 13 131.277 0.300 . 1 . . . . A 405 PHE CE1 . 36430 1 217 . 1 . 1 23 23 PHE CE2 C 13 131.277 0.300 . 1 . . . . A 405 PHE CE2 . 36430 1 218 . 1 . 1 23 23 PHE CZ C 13 129.801 0.300 . 1 . . . . A 405 PHE CZ . 36430 1 219 . 1 . 1 23 23 PHE N N 15 113.682 0.300 . 1 . . . . A 405 PHE N . 36430 1 220 . 1 . 1 24 24 GLN H H 1 8.471 0.030 . 1 . . . . A 406 GLN H . 36430 1 221 . 1 . 1 24 24 GLN HA H 1 4.461 0.030 . 1 . . . . A 406 GLN HA . 36430 1 222 . 1 . 1 24 24 GLN HB2 H 1 2.179 0.030 . 2 . . . . A 406 GLN HB2 . 36430 1 223 . 1 . 1 24 24 GLN HB3 H 1 1.978 0.030 . 2 . . . . A 406 GLN HB3 . 36430 1 224 . 1 . 1 24 24 GLN HG2 H 1 2.443 0.030 . 1 . . . . A 406 GLN HG2 . 36430 1 225 . 1 . 1 24 24 GLN HG3 H 1 2.443 0.030 . 1 . . . . A 406 GLN HG3 . 36430 1 226 . 1 . 1 24 24 GLN HE21 H 1 6.893 0.030 . 2 . . . . A 406 GLN HE21 . 36430 1 227 . 1 . 1 24 24 GLN HE22 H 1 7.384 0.030 . 2 . . . . A 406 GLN HE22 . 36430 1 228 . 1 . 1 24 24 GLN C C 13 174.534 0.300 . 1 . . . . A 406 GLN C . 36430 1 229 . 1 . 1 24 24 GLN CA C 13 54.392 0.300 . 1 . . . . A 406 GLN CA . 36430 1 230 . 1 . 1 24 24 GLN CB C 13 30.546 0.300 . 1 . . . . A 406 GLN CB . 36430 1 231 . 1 . 1 24 24 GLN CG C 13 34.135 0.300 . 1 . . . . A 406 GLN CG . 36430 1 232 . 1 . 1 24 24 GLN N N 15 119.399 0.300 . 1 . . . . A 406 GLN N . 36430 1 233 . 1 . 1 24 24 GLN NE2 N 15 112.222 0.300 . 1 . . . . A 406 GLN NE2 . 36430 1 234 . 1 . 1 25 25 ARG H H 1 8.151 0.030 . 1 . . . . A 407 ARG H . 36430 1 235 . 1 . 1 25 25 ARG HA H 1 4.569 0.030 . 1 . . . . A 407 ARG HA . 36430 1 236 . 1 . 1 25 25 ARG HB2 H 1 1.978 0.030 . 2 . . . . A 407 ARG HB2 . 36430 1 237 . 1 . 1 25 25 ARG HB3 H 1 1.751 0.030 . 2 . . . . A 407 ARG HB3 . 36430 1 238 . 1 . 1 25 25 ARG HG2 H 1 1.838 0.030 . 2 . . . . A 407 ARG HG2 . 36430 1 239 . 1 . 1 25 25 ARG HG3 H 1 1.623 0.030 . 2 . . . . A 407 ARG HG3 . 36430 1 240 . 1 . 1 25 25 ARG HD2 H 1 3.269 0.030 . 1 . . . . A 407 ARG HD2 . 36430 1 241 . 1 . 1 25 25 ARG HD3 H 1 3.269 0.030 . 1 . . . . A 407 ARG HD3 . 36430 1 242 . 1 . 1 25 25 ARG C C 13 176.052 0.300 . 1 . . . . A 407 ARG C . 36430 1 243 . 1 . 1 25 25 ARG CA C 13 55.373 0.300 . 1 . . . . A 407 ARG CA . 36430 1 244 . 1 . 1 25 25 ARG CB C 13 30.303 0.300 . 1 . . . . A 407 ARG CB . 36430 1 245 . 1 . 1 25 25 ARG CG C 13 28.323 0.300 . 1 . . . . A 407 ARG CG . 36430 1 246 . 1 . 1 25 25 ARG CD C 13 42.711 0.300 . 1 . . . . A 407 ARG CD . 36430 1 247 . 1 . 1 25 25 ARG N N 15 116.807 0.300 . 1 . . . . A 407 ARG N . 36430 1 248 . 1 . 1 26 26 GLY H H 1 7.290 0.030 . 1 . . . . A 408 GLY H . 36430 1 249 . 1 . 1 26 26 GLY HA2 H 1 3.820 0.030 . 2 . . . . A 408 GLY HA2 . 36430 1 250 . 1 . 1 26 26 GLY HA3 H 1 3.451 0.030 . 2 . . . . A 408 GLY HA3 . 36430 1 251 . 1 . 1 26 26 GLY C C 13 172.749 0.300 . 1 . . . . A 408 GLY C . 36430 1 252 . 1 . 1 26 26 GLY CA C 13 44.801 0.300 . 1 . . . . A 408 GLY CA . 36430 1 253 . 1 . 1 26 26 GLY N N 15 106.273 0.300 . 1 . . . . A 408 GLY N . 36430 1 254 . 1 . 1 27 27 LYS HA H 1 4.117 0.030 . 1 . . . . A 409 LYS HA . 36430 1 255 . 1 . 1 27 27 LYS HB2 H 1 1.758 0.030 . 1 . . . . A 409 LYS HB2 . 36430 1 256 . 1 . 1 27 27 LYS HB3 H 1 1.758 0.030 . 1 . . . . A 409 LYS HB3 . 36430 1 257 . 1 . 1 27 27 LYS HG2 H 1 1.404 0.030 . 2 . . . . A 409 LYS HG2 . 36430 1 258 . 1 . 1 27 27 LYS HG3 H 1 1.484 0.030 . 2 . . . . A 409 LYS HG3 . 36430 1 259 . 1 . 1 27 27 LYS HD2 H 1 1.690 0.030 . 1 . . . . A 409 LYS HD2 . 36430 1 260 . 1 . 1 27 27 LYS HD3 H 1 1.690 0.030 . 1 . . . . A 409 LYS HD3 . 36430 1 261 . 1 . 1 27 27 LYS HE2 H 1 2.991 0.030 . 1 . . . . A 409 LYS HE2 . 36430 1 262 . 1 . 1 27 27 LYS HE3 H 1 2.991 0.030 . 1 . . . . A 409 LYS HE3 . 36430 1 263 . 1 . 1 27 27 LYS CA C 13 58.146 0.300 . 1 . . . . A 409 LYS CA . 36430 1 264 . 1 . 1 27 27 LYS CB C 13 32.391 0.300 . 1 . . . . A 409 LYS CB . 36430 1 265 . 1 . 1 27 27 LYS CG C 13 24.763 0.300 . 1 . . . . A 409 LYS CG . 36430 1 266 . 1 . 1 27 27 LYS CD C 13 29.436 0.300 . 1 . . . . A 409 LYS CD . 36430 1 267 . 1 . 1 27 27 LYS CE C 13 42.060 0.300 . 1 . . . . A 409 LYS CE . 36430 1 268 . 1 . 1 28 28 ASN HA H 1 4.816 0.030 . 1 . . . . A 410 ASN HA . 36430 1 269 . 1 . 1 28 28 ASN HB2 H 1 3.237 0.030 . 2 . . . . A 410 ASN HB2 . 36430 1 270 . 1 . 1 28 28 ASN HB3 H 1 3.018 0.030 . 2 . . . . A 410 ASN HB3 . 36430 1 271 . 1 . 1 28 28 ASN HD21 H 1 6.895 0.030 . 2 . . . . A 410 ASN HD21 . 36430 1 272 . 1 . 1 28 28 ASN HD22 H 1 7.652 0.030 . 2 . . . . A 410 ASN HD22 . 36430 1 273 . 1 . 1 28 28 ASN C C 13 175.513 0.300 . 1 . . . . A 410 ASN C . 36430 1 274 . 1 . 1 28 28 ASN CA C 13 53.682 0.300 . 1 . . . . A 410 ASN CA . 36430 1 275 . 1 . 1 28 28 ASN CB C 13 37.426 0.300 . 1 . . . . A 410 ASN CB . 36430 1 276 . 1 . 1 28 28 ASN ND2 N 15 112.764 0.300 . 1 . . . . A 410 ASN ND2 . 36430 1 277 . 1 . 1 29 29 LEU H H 1 7.584 0.030 . 1 . . . . A 411 LEU H . 36430 1 278 . 1 . 1 29 29 LEU HA H 1 3.736 0.030 . 1 . . . . A 411 LEU HA . 36430 1 279 . 1 . 1 29 29 LEU HB2 H 1 1.912 0.030 . 1 . . . . A 411 LEU HB2 . 36430 1 280 . 1 . 1 29 29 LEU HB3 H 1 1.912 0.030 . 1 . . . . A 411 LEU HB3 . 36430 1 281 . 1 . 1 29 29 LEU HG H 1 1.115 0.030 . 1 . . . . A 411 LEU HG . 36430 1 282 . 1 . 1 29 29 LEU HD11 H 1 0.897 0.030 . 2 . . . . A 411 LEU HD11 . 36430 1 283 . 1 . 1 29 29 LEU HD12 H 1 0.897 0.030 . 2 . . . . A 411 LEU HD12 . 36430 1 284 . 1 . 1 29 29 LEU HD13 H 1 0.897 0.030 . 2 . . . . A 411 LEU HD13 . 36430 1 285 . 1 . 1 29 29 LEU HD21 H 1 0.592 0.030 . 2 . . . . A 411 LEU HD21 . 36430 1 286 . 1 . 1 29 29 LEU HD22 H 1 0.592 0.030 . 2 . . . . A 411 LEU HD22 . 36430 1 287 . 1 . 1 29 29 LEU HD23 H 1 0.592 0.030 . 2 . . . . A 411 LEU HD23 . 36430 1 288 . 1 . 1 29 29 LEU C C 13 177.036 0.300 . 1 . . . . A 411 LEU C . 36430 1 289 . 1 . 1 29 29 LEU CA C 13 58.889 0.300 . 1 . . . . A 411 LEU CA . 36430 1 290 . 1 . 1 29 29 LEU CB C 13 42.552 0.300 . 1 . . . . A 411 LEU CB . 36430 1 291 . 1 . 1 29 29 LEU CG C 13 27.606 0.300 . 1 . . . . A 411 LEU CG . 36430 1 292 . 1 . 1 29 29 LEU CD1 C 13 26.901 0.300 . 2 . . . . A 411 LEU CD1 . 36430 1 293 . 1 . 1 29 29 LEU CD2 C 13 22.804 0.300 . 2 . . . . A 411 LEU CD2 . 36430 1 294 . 1 . 1 29 29 LEU N N 15 120.017 0.300 . 1 . . . . A 411 LEU N . 36430 1 295 . 1 . 1 30 30 ARG H H 1 8.663 0.030 . 1 . . . . A 412 ARG H . 36430 1 296 . 1 . 1 30 30 ARG HA H 1 3.455 0.030 . 1 . . . . A 412 ARG HA . 36430 1 297 . 1 . 1 30 30 ARG HB2 H 1 1.779 0.030 . 2 . . . . A 412 ARG HB2 . 36430 1 298 . 1 . 1 30 30 ARG HB3 H 1 1.661 0.030 . 2 . . . . A 412 ARG HB3 . 36430 1 299 . 1 . 1 30 30 ARG HG2 H 1 1.265 0.030 . 2 . . . . A 412 ARG HG2 . 36430 1 300 . 1 . 1 30 30 ARG HG3 H 1 1.191 0.030 . 2 . . . . A 412 ARG HG3 . 36430 1 301 . 1 . 1 30 30 ARG HD2 H 1 3.219 0.030 . 2 . . . . A 412 ARG HD2 . 36430 1 302 . 1 . 1 30 30 ARG HD3 H 1 3.103 0.030 . 2 . . . . A 412 ARG HD3 . 36430 1 303 . 1 . 1 30 30 ARG C C 13 176.611 0.300 . 1 . . . . A 412 ARG C . 36430 1 304 . 1 . 1 30 30 ARG CA C 13 60.563 0.300 . 1 . . . . A 412 ARG CA . 36430 1 305 . 1 . 1 30 30 ARG CB C 13 29.641 0.300 . 1 . . . . A 412 ARG CB . 36430 1 306 . 1 . 1 30 30 ARG CG C 13 26.730 0.300 . 1 . . . . A 412 ARG CG . 36430 1 307 . 1 . 1 30 30 ARG CD C 13 43.559 0.300 . 1 . . . . A 412 ARG CD . 36430 1 308 . 1 . 1 30 30 ARG N N 15 117.118 0.300 . 1 . . . . A 412 ARG N . 36430 1 309 . 1 . 1 31 31 TYR H H 1 7.393 0.030 . 1 . . . . A 413 TYR H . 36430 1 310 . 1 . 1 31 31 TYR HA H 1 3.972 0.030 . 1 . . . . A 413 TYR HA . 36430 1 311 . 1 . 1 31 31 TYR HB2 H 1 3.030 0.030 . 2 . . . . A 413 TYR HB2 . 36430 1 312 . 1 . 1 31 31 TYR HB3 H 1 2.940 0.030 . 2 . . . . A 413 TYR HB3 . 36430 1 313 . 1 . 1 31 31 TYR HD1 H 1 7.000 0.030 . 1 . . . . A 413 TYR HD1 . 36430 1 314 . 1 . 1 31 31 TYR HD2 H 1 7.000 0.030 . 1 . . . . A 413 TYR HD2 . 36430 1 315 . 1 . 1 31 31 TYR HE1 H 1 6.761 0.030 . 1 . . . . A 413 TYR HE1 . 36430 1 316 . 1 . 1 31 31 TYR HE2 H 1 6.761 0.030 . 1 . . . . A 413 TYR HE2 . 36430 1 317 . 1 . 1 31 31 TYR C C 13 177.570 0.300 . 1 . . . . A 413 TYR C . 36430 1 318 . 1 . 1 31 31 TYR CA C 13 61.091 0.300 . 1 . . . . A 413 TYR CA . 36430 1 319 . 1 . 1 31 31 TYR CB C 13 38.245 0.300 . 1 . . . . A 413 TYR CB . 36430 1 320 . 1 . 1 31 31 TYR CD1 C 13 132.963 0.300 . 1 . . . . A 413 TYR CD1 . 36430 1 321 . 1 . 1 31 31 TYR CD2 C 13 132.963 0.300 . 1 . . . . A 413 TYR CD2 . 36430 1 322 . 1 . 1 31 31 TYR CE1 C 13 118.317 0.300 . 1 . . . . A 413 TYR CE1 . 36430 1 323 . 1 . 1 31 31 TYR CE2 C 13 118.317 0.300 . 1 . . . . A 413 TYR CE2 . 36430 1 324 . 1 . 1 31 31 TYR N N 15 116.404 0.300 . 1 . . . . A 413 TYR N . 36430 1 325 . 1 . 1 32 32 GLN H H 1 7.551 0.030 . 1 . . . . A 414 GLN H . 36430 1 326 . 1 . 1 32 32 GLN HA H 1 3.688 0.030 . 1 . . . . A 414 GLN HA . 36430 1 327 . 1 . 1 32 32 GLN HB2 H 1 1.967 0.030 . 2 . . . . A 414 GLN HB2 . 36430 1 328 . 1 . 1 32 32 GLN HB3 H 1 1.702 0.030 . 2 . . . . A 414 GLN HB3 . 36430 1 329 . 1 . 1 32 32 GLN HG2 H 1 2.231 0.030 . 2 . . . . A 414 GLN HG2 . 36430 1 330 . 1 . 1 32 32 GLN HG3 H 1 1.848 0.030 . 2 . . . . A 414 GLN HG3 . 36430 1 331 . 1 . 1 32 32 GLN HE21 H 1 6.492 0.030 . 2 . . . . A 414 GLN HE21 . 36430 1 332 . 1 . 1 32 32 GLN HE22 H 1 7.196 0.030 . 2 . . . . A 414 GLN HE22 . 36430 1 333 . 1 . 1 32 32 GLN C C 13 178.601 0.300 . 1 . . . . A 414 GLN C . 36430 1 334 . 1 . 1 32 32 GLN CA C 13 58.660 0.300 . 1 . . . . A 414 GLN CA . 36430 1 335 . 1 . 1 32 32 GLN CB C 13 28.688 0.300 . 1 . . . . A 414 GLN CB . 36430 1 336 . 1 . 1 32 32 GLN CG C 13 33.867 0.300 . 1 . . . . A 414 GLN CG . 36430 1 337 . 1 . 1 32 32 GLN N N 15 115.584 0.300 . 1 . . . . A 414 GLN N . 36430 1 338 . 1 . 1 32 32 GLN NE2 N 15 112.857 0.300 . 1 . . . . A 414 GLN NE2 . 36430 1 339 . 1 . 1 33 33 LEU H H 1 7.910 0.030 . 1 . . . . A 415 LEU H . 36430 1 340 . 1 . 1 33 33 LEU HA H 1 3.768 0.030 . 1 . . . . A 415 LEU HA . 36430 1 341 . 1 . 1 33 33 LEU HB2 H 1 1.643 0.030 . 2 . . . . A 415 LEU HB2 . 36430 1 342 . 1 . 1 33 33 LEU HB3 H 1 0.782 0.030 . 2 . . . . A 415 LEU HB3 . 36430 1 343 . 1 . 1 33 33 LEU HG H 1 1.360 0.030 . 1 . . . . A 415 LEU HG . 36430 1 344 . 1 . 1 33 33 LEU HD11 H 1 0.012 0.030 . 2 . . . . A 415 LEU HD11 . 36430 1 345 . 1 . 1 33 33 LEU HD12 H 1 0.012 0.030 . 2 . . . . A 415 LEU HD12 . 36430 1 346 . 1 . 1 33 33 LEU HD13 H 1 0.012 0.030 . 2 . . . . A 415 LEU HD13 . 36430 1 347 . 1 . 1 33 33 LEU HD21 H 1 0.255 0.030 . 2 . . . . A 415 LEU HD21 . 36430 1 348 . 1 . 1 33 33 LEU HD22 H 1 0.255 0.030 . 2 . . . . A 415 LEU HD22 . 36430 1 349 . 1 . 1 33 33 LEU HD23 H 1 0.255 0.030 . 2 . . . . A 415 LEU HD23 . 36430 1 350 . 1 . 1 33 33 LEU C C 13 178.035 0.300 . 1 . . . . A 415 LEU C . 36430 1 351 . 1 . 1 33 33 LEU CA C 13 57.157 0.300 . 1 . . . . A 415 LEU CA . 36430 1 352 . 1 . 1 33 33 LEU CB C 13 41.827 0.300 . 1 . . . . A 415 LEU CB . 36430 1 353 . 1 . 1 33 33 LEU CG C 13 25.504 0.300 . 1 . . . . A 415 LEU CG . 36430 1 354 . 1 . 1 33 33 LEU CD1 C 13 26.060 0.300 . 2 . . . . A 415 LEU CD1 . 36430 1 355 . 1 . 1 33 33 LEU CD2 C 13 23.328 0.300 . 2 . . . . A 415 LEU CD2 . 36430 1 356 . 1 . 1 33 33 LEU N N 15 116.572 0.300 . 1 . . . . A 415 LEU N . 36430 1 357 . 1 . 1 34 34 LEU H H 1 7.964 0.030 . 1 . . . . A 416 LEU H . 36430 1 358 . 1 . 1 34 34 LEU HA H 1 3.772 0.030 . 1 . . . . A 416 LEU HA . 36430 1 359 . 1 . 1 34 34 LEU HB2 H 1 1.609 0.030 . 2 . . . . A 416 LEU HB2 . 36430 1 360 . 1 . 1 34 34 LEU HB3 H 1 1.310 0.030 . 2 . . . . A 416 LEU HB3 . 36430 1 361 . 1 . 1 34 34 LEU HG H 1 1.550 0.030 . 1 . . . . A 416 LEU HG . 36430 1 362 . 1 . 1 34 34 LEU HD11 H 1 0.440 0.030 . 2 . . . . A 416 LEU HD11 . 36430 1 363 . 1 . 1 34 34 LEU HD12 H 1 0.440 0.030 . 2 . . . . A 416 LEU HD12 . 36430 1 364 . 1 . 1 34 34 LEU HD13 H 1 0.440 0.030 . 2 . . . . A 416 LEU HD13 . 36430 1 365 . 1 . 1 34 34 LEU HD21 H 1 0.391 0.030 . 2 . . . . A 416 LEU HD21 . 36430 1 366 . 1 . 1 34 34 LEU HD22 H 1 0.391 0.030 . 2 . . . . A 416 LEU HD22 . 36430 1 367 . 1 . 1 34 34 LEU HD23 H 1 0.391 0.030 . 2 . . . . A 416 LEU HD23 . 36430 1 368 . 1 . 1 34 34 LEU C C 13 180.254 0.300 . 1 . . . . A 416 LEU C . 36430 1 369 . 1 . 1 34 34 LEU CA C 13 58.092 0.300 . 1 . . . . A 416 LEU CA . 36430 1 370 . 1 . 1 34 34 LEU CB C 13 39.733 0.300 . 1 . . . . A 416 LEU CB . 36430 1 371 . 1 . 1 34 34 LEU CG C 13 26.980 0.300 . 1 . . . . A 416 LEU CG . 36430 1 372 . 1 . 1 34 34 LEU CD1 C 13 24.714 0.300 . 2 . . . . A 416 LEU CD1 . 36430 1 373 . 1 . 1 34 34 LEU CD2 C 13 21.808 0.300 . 2 . . . . A 416 LEU CD2 . 36430 1 374 . 1 . 1 34 34 LEU N N 15 116.413 0.300 . 1 . . . . A 416 LEU N . 36430 1 375 . 1 . 1 35 35 GLN H H 1 7.916 0.030 . 1 . . . . A 417 GLN H . 36430 1 376 . 1 . 1 35 35 GLN HA H 1 3.869 0.030 . 1 . . . . A 417 GLN HA . 36430 1 377 . 1 . 1 35 35 GLN HB2 H 1 1.827 0.030 . 2 . . . . A 417 GLN HB2 . 36430 1 378 . 1 . 1 35 35 GLN HB3 H 1 1.917 0.030 . 2 . . . . A 417 GLN HB3 . 36430 1 379 . 1 . 1 35 35 GLN HG2 H 1 2.051 0.030 . 2 . . . . A 417 GLN HG2 . 36430 1 380 . 1 . 1 35 35 GLN HG3 H 1 1.981 0.030 . 2 . . . . A 417 GLN HG3 . 36430 1 381 . 1 . 1 35 35 GLN HE21 H 1 6.674 0.030 . 2 . . . . A 417 GLN HE21 . 36430 1 382 . 1 . 1 35 35 GLN HE22 H 1 7.293 0.030 . 2 . . . . A 417 GLN HE22 . 36430 1 383 . 1 . 1 35 35 GLN C C 13 177.531 0.300 . 1 . . . . A 417 GLN C . 36430 1 384 . 1 . 1 35 35 GLN CA C 13 58.003 0.300 . 1 . . . . A 417 GLN CA . 36430 1 385 . 1 . 1 35 35 GLN CB C 13 28.308 0.300 . 1 . . . . A 417 GLN CB . 36430 1 386 . 1 . 1 35 35 GLN CG C 13 34.166 0.300 . 1 . . . . A 417 GLN CG . 36430 1 387 . 1 . 1 35 35 GLN N N 15 116.299 0.300 . 1 . . . . A 417 GLN N . 36430 1 388 . 1 . 1 35 35 GLN NE2 N 15 112.636 0.300 . 1 . . . . A 417 GLN NE2 . 36430 1 389 . 1 . 1 36 36 LEU H H 1 7.243 0.030 . 1 . . . . A 418 LEU H . 36430 1 390 . 1 . 1 36 36 LEU HA H 1 4.245 0.030 . 1 . . . . A 418 LEU HA . 36430 1 391 . 1 . 1 36 36 LEU HB2 H 1 2.080 0.030 . 2 . . . . A 418 LEU HB2 . 36430 1 392 . 1 . 1 36 36 LEU HB3 H 1 1.116 0.030 . 2 . . . . A 418 LEU HB3 . 36430 1 393 . 1 . 1 36 36 LEU HG H 1 1.950 0.030 . 1 . . . . A 418 LEU HG . 36430 1 394 . 1 . 1 36 36 LEU HD11 H 1 0.480 0.030 . 2 . . . . A 418 LEU HD11 . 36430 1 395 . 1 . 1 36 36 LEU HD12 H 1 0.480 0.030 . 2 . . . . A 418 LEU HD12 . 36430 1 396 . 1 . 1 36 36 LEU HD13 H 1 0.480 0.030 . 2 . . . . A 418 LEU HD13 . 36430 1 397 . 1 . 1 36 36 LEU HD21 H 1 0.699 0.030 . 2 . . . . A 418 LEU HD21 . 36430 1 398 . 1 . 1 36 36 LEU HD22 H 1 0.699 0.030 . 2 . . . . A 418 LEU HD22 . 36430 1 399 . 1 . 1 36 36 LEU HD23 H 1 0.699 0.030 . 2 . . . . A 418 LEU HD23 . 36430 1 400 . 1 . 1 36 36 LEU C C 13 180.152 0.300 . 1 . . . . A 418 LEU C . 36430 1 401 . 1 . 1 36 36 LEU CA C 13 57.152 0.300 . 1 . . . . A 418 LEU CA . 36430 1 402 . 1 . 1 36 36 LEU CB C 13 42.926 0.300 . 1 . . . . A 418 LEU CB . 36430 1 403 . 1 . 1 36 36 LEU CG C 13 26.012 0.300 . 1 . . . . A 418 LEU CG . 36430 1 404 . 1 . 1 36 36 LEU CD1 C 13 25.852 0.300 . 2 . . . . A 418 LEU CD1 . 36430 1 405 . 1 . 1 36 36 LEU CD2 C 13 22.223 0.300 . 2 . . . . A 418 LEU CD2 . 36430 1 406 . 1 . 1 36 36 LEU N N 15 115.104 0.300 . 1 . . . . A 418 LEU N . 36430 1 407 . 1 . 1 37 37 VAL H H 1 7.163 0.030 . 1 . . . . A 419 VAL H . 36430 1 408 . 1 . 1 37 37 VAL HA H 1 5.060 0.030 . 1 . . . . A 419 VAL HA . 36430 1 409 . 1 . 1 37 37 VAL HB H 1 2.481 0.030 . 1 . . . . A 419 VAL HB . 36430 1 410 . 1 . 1 37 37 VAL HG11 H 1 0.898 0.030 . 2 . . . . A 419 VAL HG11 . 36430 1 411 . 1 . 1 37 37 VAL HG12 H 1 0.898 0.030 . 2 . . . . A 419 VAL HG12 . 36430 1 412 . 1 . 1 37 37 VAL HG13 H 1 0.898 0.030 . 2 . . . . A 419 VAL HG13 . 36430 1 413 . 1 . 1 37 37 VAL HG21 H 1 1.009 0.030 . 2 . . . . A 419 VAL HG21 . 36430 1 414 . 1 . 1 37 37 VAL HG22 H 1 1.009 0.030 . 2 . . . . A 419 VAL HG22 . 36430 1 415 . 1 . 1 37 37 VAL HG23 H 1 1.009 0.030 . 2 . . . . A 419 VAL HG23 . 36430 1 416 . 1 . 1 37 37 VAL C C 13 175.139 0.300 . 1 . . . . A 419 VAL C . 36430 1 417 . 1 . 1 37 37 VAL CA C 13 61.372 0.300 . 1 . . . . A 419 VAL CA . 36430 1 418 . 1 . 1 37 37 VAL CB C 13 32.977 0.300 . 1 . . . . A 419 VAL CB . 36430 1 419 . 1 . 1 37 37 VAL CG1 C 13 22.271 0.300 . 2 . . . . A 419 VAL CG1 . 36430 1 420 . 1 . 1 37 37 VAL CG2 C 13 20.447 0.300 . 2 . . . . A 419 VAL CG2 . 36430 1 421 . 1 . 1 37 37 VAL N N 15 106.390 0.300 . 1 . . . . A 419 VAL N . 36430 1 422 . 1 . 1 38 38 GLU H H 1 8.029 0.030 . 1 . . . . A 420 GLU H . 36430 1 423 . 1 . 1 38 38 GLU HA H 1 4.283 0.030 . 1 . . . . A 420 GLU HA . 36430 1 424 . 1 . 1 38 38 GLU HB2 H 1 1.979 0.030 . 1 . . . . A 420 GLU HB2 . 36430 1 425 . 1 . 1 38 38 GLU HB3 H 1 1.979 0.030 . 1 . . . . A 420 GLU HB3 . 36430 1 426 . 1 . 1 38 38 GLU HG2 H 1 2.340 0.030 . 2 . . . . A 420 GLU HG2 . 36430 1 427 . 1 . 1 38 38 GLU HG3 H 1 2.229 0.030 . 2 . . . . A 420 GLU HG3 . 36430 1 428 . 1 . 1 38 38 GLU C C 13 174.497 0.300 . 1 . . . . A 420 GLU C . 36430 1 429 . 1 . 1 38 38 GLU CA C 13 60.245 0.300 . 1 . . . . A 420 GLU CA . 36430 1 430 . 1 . 1 38 38 GLU CB C 13 28.538 0.300 . 1 . . . . A 420 GLU CB . 36430 1 431 . 1 . 1 38 38 GLU CG C 13 37.004 0.300 . 1 . . . . A 420 GLU CG . 36430 1 432 . 1 . 1 38 38 GLU N N 15 124.003 0.300 . 1 . . . . A 420 GLU N . 36430 1 433 . 1 . 1 39 39 PRO HA H 1 4.082 0.030 . 1 . . . . A 421 PRO HA . 36430 1 434 . 1 . 1 39 39 PRO HB2 H 1 1.829 0.030 . 2 . . . . A 421 PRO HB2 . 36430 1 435 . 1 . 1 39 39 PRO HB3 H 1 0.337 0.030 . 2 . . . . A 421 PRO HB3 . 36430 1 436 . 1 . 1 39 39 PRO HG2 H 1 1.674 0.030 . 1 . . . . A 421 PRO HG2 . 36430 1 437 . 1 . 1 39 39 PRO HG3 H 1 1.674 0.030 . 1 . . . . A 421 PRO HG3 . 36430 1 438 . 1 . 1 39 39 PRO HD2 H 1 3.700 0.030 . 2 . . . . A 421 PRO HD2 . 36430 1 439 . 1 . 1 39 39 PRO HD3 H 1 3.002 0.030 . 2 . . . . A 421 PRO HD3 . 36430 1 440 . 1 . 1 39 39 PRO C C 13 176.960 0.300 . 1 . . . . A 421 PRO C . 36430 1 441 . 1 . 1 39 39 PRO CA C 13 64.875 0.300 . 1 . . . . A 421 PRO CA . 36430 1 442 . 1 . 1 39 39 PRO CB C 13 30.939 0.300 . 1 . . . . A 421 PRO CB . 36430 1 443 . 1 . 1 39 39 PRO CG C 13 28.087 0.300 . 1 . . . . A 421 PRO CG . 36430 1 444 . 1 . 1 39 39 PRO CD C 13 51.577 0.300 . 1 . . . . A 421 PRO CD . 36430 1 445 . 1 . 1 40 40 PHE H H 1 7.867 0.030 . 1 . . . . A 422 PHE H . 36430 1 446 . 1 . 1 40 40 PHE HA H 1 4.144 0.030 . 1 . . . . A 422 PHE HA . 36430 1 447 . 1 . 1 40 40 PHE HB2 H 1 3.435 0.030 . 2 . . . . A 422 PHE HB2 . 36430 1 448 . 1 . 1 40 40 PHE HB3 H 1 2.781 0.030 . 2 . . . . A 422 PHE HB3 . 36430 1 449 . 1 . 1 40 40 PHE HD1 H 1 7.221 0.030 . 1 . . . . A 422 PHE HD1 . 36430 1 450 . 1 . 1 40 40 PHE HD2 H 1 7.221 0.030 . 1 . . . . A 422 PHE HD2 . 36430 1 451 . 1 . 1 40 40 PHE HE1 H 1 7.042 0.030 . 1 . . . . A 422 PHE HE1 . 36430 1 452 . 1 . 1 40 40 PHE HE2 H 1 7.042 0.030 . 1 . . . . A 422 PHE HE2 . 36430 1 453 . 1 . 1 40 40 PHE HZ H 1 5.835 0.030 . 1 . . . . A 422 PHE HZ . 36430 1 454 . 1 . 1 40 40 PHE C C 13 174.572 0.300 . 1 . . . . A 422 PHE C . 36430 1 455 . 1 . 1 40 40 PHE CA C 13 59.251 0.300 . 1 . . . . A 422 PHE CA . 36430 1 456 . 1 . 1 40 40 PHE CB C 13 39.701 0.300 . 1 . . . . A 422 PHE CB . 36430 1 457 . 1 . 1 40 40 PHE CD1 C 13 131.476 0.300 . 1 . . . . A 422 PHE CD1 . 36430 1 458 . 1 . 1 40 40 PHE CD2 C 13 131.476 0.300 . 1 . . . . A 422 PHE CD2 . 36430 1 459 . 1 . 1 40 40 PHE CE1 C 13 131.048 0.300 . 1 . . . . A 422 PHE CE1 . 36430 1 460 . 1 . 1 40 40 PHE CE2 C 13 131.048 0.300 . 1 . . . . A 422 PHE CE2 . 36430 1 461 . 1 . 1 40 40 PHE CZ C 13 129.679 0.300 . 1 . . . . A 422 PHE CZ . 36430 1 462 . 1 . 1 40 40 PHE N N 15 112.721 0.300 . 1 . . . . A 422 PHE N . 36430 1 463 . 1 . 1 41 41 GLY H H 1 7.216 0.030 . 1 . . . . A 423 GLY H . 36430 1 464 . 1 . 1 41 41 GLY HA2 H 1 4.326 0.030 . 2 . . . . A 423 GLY HA2 . 36430 1 465 . 1 . 1 41 41 GLY HA3 H 1 3.749 0.030 . 2 . . . . A 423 GLY HA3 . 36430 1 466 . 1 . 1 41 41 GLY C C 13 170.983 0.300 . 1 . . . . A 423 GLY C . 36430 1 467 . 1 . 1 41 41 GLY CA C 13 45.009 0.300 . 1 . . . . A 423 GLY CA . 36430 1 468 . 1 . 1 41 41 GLY N N 15 104.049 0.300 . 1 . . . . A 423 GLY N . 36430 1 469 . 1 . 1 42 42 VAL H H 1 8.140 0.030 . 1 . . . . A 424 VAL H . 36430 1 470 . 1 . 1 42 42 VAL HA H 1 3.831 0.030 . 1 . . . . A 424 VAL HA . 36430 1 471 . 1 . 1 42 42 VAL HB H 1 1.889 0.030 . 1 . . . . A 424 VAL HB . 36430 1 472 . 1 . 1 42 42 VAL HG11 H 1 0.999 0.030 . 2 . . . . A 424 VAL HG11 . 36430 1 473 . 1 . 1 42 42 VAL HG12 H 1 0.999 0.030 . 2 . . . . A 424 VAL HG12 . 36430 1 474 . 1 . 1 42 42 VAL HG13 H 1 0.999 0.030 . 2 . . . . A 424 VAL HG13 . 36430 1 475 . 1 . 1 42 42 VAL HG21 H 1 0.856 0.030 . 2 . . . . A 424 VAL HG21 . 36430 1 476 . 1 . 1 42 42 VAL HG22 H 1 0.856 0.030 . 2 . . . . A 424 VAL HG22 . 36430 1 477 . 1 . 1 42 42 VAL HG23 H 1 0.856 0.030 . 2 . . . . A 424 VAL HG23 . 36430 1 478 . 1 . 1 42 42 VAL C C 13 176.012 0.300 . 1 . . . . A 424 VAL C . 36430 1 479 . 1 . 1 42 42 VAL CA C 13 63.228 0.300 . 1 . . . . A 424 VAL CA . 36430 1 480 . 1 . 1 42 42 VAL CB C 13 32.869 0.300 . 1 . . . . A 424 VAL CB . 36430 1 481 . 1 . 1 42 42 VAL CG1 C 13 22.144 0.300 . 2 . . . . A 424 VAL CG1 . 36430 1 482 . 1 . 1 42 42 VAL CG2 C 13 21.269 0.300 . 2 . . . . A 424 VAL CG2 . 36430 1 483 . 1 . 1 42 42 VAL N N 15 118.985 0.300 . 1 . . . . A 424 VAL N . 36430 1 484 . 1 . 1 43 43 ILE H H 1 8.553 0.030 . 1 . . . . A 425 ILE H . 36430 1 485 . 1 . 1 43 43 ILE HA H 1 4.310 0.030 . 1 . . . . A 425 ILE HA . 36430 1 486 . 1 . 1 43 43 ILE HB H 1 1.770 0.030 . 1 . . . . A 425 ILE HB . 36430 1 487 . 1 . 1 43 43 ILE HG12 H 1 1.697 0.030 . 2 . . . . A 425 ILE HG12 . 36430 1 488 . 1 . 1 43 43 ILE HG13 H 1 0.969 0.030 . 2 . . . . A 425 ILE HG13 . 36430 1 489 . 1 . 1 43 43 ILE HG21 H 1 0.836 0.030 . 1 . . . . A 425 ILE HG21 . 36430 1 490 . 1 . 1 43 43 ILE HG22 H 1 0.836 0.030 . 1 . . . . A 425 ILE HG22 . 36430 1 491 . 1 . 1 43 43 ILE HG23 H 1 0.836 0.030 . 1 . . . . A 425 ILE HG23 . 36430 1 492 . 1 . 1 43 43 ILE HD11 H 1 0.880 0.030 . 1 . . . . A 425 ILE HD11 . 36430 1 493 . 1 . 1 43 43 ILE HD12 H 1 0.880 0.030 . 1 . . . . A 425 ILE HD12 . 36430 1 494 . 1 . 1 43 43 ILE HD13 H 1 0.880 0.030 . 1 . . . . A 425 ILE HD13 . 36430 1 495 . 1 . 1 43 43 ILE C C 13 176.634 0.300 . 1 . . . . A 425 ILE C . 36430 1 496 . 1 . 1 43 43 ILE CA C 13 61.666 0.300 . 1 . . . . A 425 ILE CA . 36430 1 497 . 1 . 1 43 43 ILE CB C 13 39.723 0.300 . 1 . . . . A 425 ILE CB . 36430 1 498 . 1 . 1 43 43 ILE CG1 C 13 28.140 0.300 . 1 . . . . A 425 ILE CG1 . 36430 1 499 . 1 . 1 43 43 ILE CG2 C 13 18.410 0.300 . 1 . . . . A 425 ILE CG2 . 36430 1 500 . 1 . 1 43 43 ILE CD1 C 13 15.512 0.300 . 1 . . . . A 425 ILE CD1 . 36430 1 501 . 1 . 1 43 43 ILE N N 15 128.214 0.300 . 1 . . . . A 425 ILE N . 36430 1 502 . 1 . 1 44 44 SER H H 1 9.441 0.030 . 1 . . . . A 426 SER H . 36430 1 503 . 1 . 1 44 44 SER HA H 1 4.493 0.030 . 1 . . . . A 426 SER HA . 36430 1 504 . 1 . 1 44 44 SER HB2 H 1 3.639 0.030 . 2 . . . . A 426 SER HB2 . 36430 1 505 . 1 . 1 44 44 SER HB3 H 1 3.581 0.030 . 2 . . . . A 426 SER HB3 . 36430 1 506 . 1 . 1 44 44 SER C C 13 174.556 0.300 . 1 . . . . A 426 SER C . 36430 1 507 . 1 . 1 44 44 SER CA C 13 60.045 0.300 . 1 . . . . A 426 SER CA . 36430 1 508 . 1 . 1 44 44 SER CB C 13 64.234 0.300 . 1 . . . . A 426 SER CB . 36430 1 509 . 1 . 1 44 44 SER N N 15 124.105 0.300 . 1 . . . . A 426 SER N . 36430 1 510 . 1 . 1 45 45 ASN H H 1 8.133 0.030 . 1 . . . . A 427 ASN H . 36430 1 511 . 1 . 1 45 45 ASN HA H 1 4.928 0.030 . 1 . . . . A 427 ASN HA . 36430 1 512 . 1 . 1 45 45 ASN HB2 H 1 2.803 0.030 . 2 . . . . A 427 ASN HB2 . 36430 1 513 . 1 . 1 45 45 ASN HB3 H 1 2.542 0.030 . 2 . . . . A 427 ASN HB3 . 36430 1 514 . 1 . 1 45 45 ASN HD21 H 1 6.957 0.030 . 2 . . . . A 427 ASN HD21 . 36430 1 515 . 1 . 1 45 45 ASN HD22 H 1 7.693 0.030 . 2 . . . . A 427 ASN HD22 . 36430 1 516 . 1 . 1 45 45 ASN C C 13 173.142 0.300 . 1 . . . . A 427 ASN C . 36430 1 517 . 1 . 1 45 45 ASN CA C 13 53.107 0.300 . 1 . . . . A 427 ASN CA . 36430 1 518 . 1 . 1 45 45 ASN CB C 13 41.726 0.300 . 1 . . . . A 427 ASN CB . 36430 1 519 . 1 . 1 45 45 ASN N N 15 116.634 0.300 . 1 . . . . A 427 ASN N . 36430 1 520 . 1 . 1 45 45 ASN ND2 N 15 113.573 0.300 . 1 . . . . A 427 ASN ND2 . 36430 1 521 . 1 . 1 46 46 HIS H H 1 8.532 0.030 . 1 . . . . A 428 HIS H . 36430 1 522 . 1 . 1 46 46 HIS HA H 1 5.319 0.030 . 1 . . . . A 428 HIS HA . 36430 1 523 . 1 . 1 46 46 HIS HB2 H 1 3.050 0.030 . 2 . . . . A 428 HIS HB2 . 36430 1 524 . 1 . 1 46 46 HIS HB3 H 1 2.898 0.030 . 2 . . . . A 428 HIS HB3 . 36430 1 525 . 1 . 1 46 46 HIS HD2 H 1 6.497 0.030 . 1 . . . . A 428 HIS HD2 . 36430 1 526 . 1 . 1 46 46 HIS HE1 H 1 7.677 0.030 . 1 . . . . A 428 HIS HE1 . 36430 1 527 . 1 . 1 46 46 HIS C C 13 172.084 0.300 . 1 . . . . A 428 HIS C . 36430 1 528 . 1 . 1 46 46 HIS CA C 13 56.446 0.300 . 1 . . . . A 428 HIS CA . 36430 1 529 . 1 . 1 46 46 HIS CB C 13 33.189 0.300 . 1 . . . . A 428 HIS CB . 36430 1 530 . 1 . 1 46 46 HIS CE1 C 13 139.405 0.300 . 1 . . . . A 428 HIS CE1 . 36430 1 531 . 1 . 1 47 47 LEU H H 1 8.960 0.030 . 1 . . . . A 429 LEU H . 36430 1 532 . 1 . 1 47 47 LEU HA H 1 4.543 0.030 . 1 . . . . A 429 LEU HA . 36430 1 533 . 1 . 1 47 47 LEU HB2 H 1 1.730 0.030 . 2 . . . . A 429 LEU HB2 . 36430 1 534 . 1 . 1 47 47 LEU HB3 H 1 1.471 0.030 . 2 . . . . A 429 LEU HB3 . 36430 1 535 . 1 . 1 47 47 LEU HG H 1 1.389 0.030 . 1 . . . . A 429 LEU HG . 36430 1 536 . 1 . 1 47 47 LEU HD11 H 1 0.692 0.030 . 2 . . . . A 429 LEU HD11 . 36430 1 537 . 1 . 1 47 47 LEU HD12 H 1 0.692 0.030 . 2 . . . . A 429 LEU HD12 . 36430 1 538 . 1 . 1 47 47 LEU HD13 H 1 0.692 0.030 . 2 . . . . A 429 LEU HD13 . 36430 1 539 . 1 . 1 47 47 LEU HD21 H 1 0.861 0.030 . 2 . . . . A 429 LEU HD21 . 36430 1 540 . 1 . 1 47 47 LEU HD22 H 1 0.861 0.030 . 2 . . . . A 429 LEU HD22 . 36430 1 541 . 1 . 1 47 47 LEU HD23 H 1 0.861 0.030 . 2 . . . . A 429 LEU HD23 . 36430 1 542 . 1 . 1 47 47 LEU C C 13 174.383 0.300 . 1 . . . . A 429 LEU C . 36430 1 543 . 1 . 1 47 47 LEU CA C 13 54.982 0.300 . 1 . . . . A 429 LEU CA . 36430 1 544 . 1 . 1 47 47 LEU CB C 13 46.309 0.300 . 1 . . . . A 429 LEU CB . 36430 1 545 . 1 . 1 47 47 LEU CG C 13 27.688 0.300 . 1 . . . . A 429 LEU CG . 36430 1 546 . 1 . 1 47 47 LEU CD1 C 13 26.093 0.300 . 2 . . . . A 429 LEU CD1 . 36430 1 547 . 1 . 1 47 47 LEU CD2 C 13 23.416 0.300 . 2 . . . . A 429 LEU CD2 . 36430 1 548 . 1 . 1 47 47 LEU N N 15 121.976 0.300 . 1 . . . . A 429 LEU N . 36430 1 549 . 1 . 1 48 48 ILE H H 1 9.071 0.030 . 1 . . . . A 430 ILE H . 36430 1 550 . 1 . 1 48 48 ILE HA H 1 4.397 0.030 . 1 . . . . A 430 ILE HA . 36430 1 551 . 1 . 1 48 48 ILE HB H 1 1.845 0.030 . 1 . . . . A 430 ILE HB . 36430 1 552 . 1 . 1 48 48 ILE HG12 H 1 1.699 0.030 . 2 . . . . A 430 ILE HG12 . 36430 1 553 . 1 . 1 48 48 ILE HG13 H 1 0.782 0.030 . 2 . . . . A 430 ILE HG13 . 36430 1 554 . 1 . 1 48 48 ILE HG21 H 1 0.970 0.030 . 1 . . . . A 430 ILE HG21 . 36430 1 555 . 1 . 1 48 48 ILE HG22 H 1 0.970 0.030 . 1 . . . . A 430 ILE HG22 . 36430 1 556 . 1 . 1 48 48 ILE HG23 H 1 0.970 0.030 . 1 . . . . A 430 ILE HG23 . 36430 1 557 . 1 . 1 48 48 ILE HD11 H 1 0.798 0.030 . 1 . . . . A 430 ILE HD11 . 36430 1 558 . 1 . 1 48 48 ILE HD12 H 1 0.798 0.030 . 1 . . . . A 430 ILE HD12 . 36430 1 559 . 1 . 1 48 48 ILE HD13 H 1 0.798 0.030 . 1 . . . . A 430 ILE HD13 . 36430 1 560 . 1 . 1 48 48 ILE C C 13 175.950 0.300 . 1 . . . . A 430 ILE C . 36430 1 561 . 1 . 1 48 48 ILE CA C 13 61.247 0.300 . 1 . . . . A 430 ILE CA . 36430 1 562 . 1 . 1 48 48 ILE CB C 13 39.315 0.300 . 1 . . . . A 430 ILE CB . 36430 1 563 . 1 . 1 48 48 ILE CG1 C 13 27.855 0.300 . 1 . . . . A 430 ILE CG1 . 36430 1 564 . 1 . 1 48 48 ILE CG2 C 13 17.579 0.300 . 1 . . . . A 430 ILE CG2 . 36430 1 565 . 1 . 1 48 48 ILE CD1 C 13 13.897 0.300 . 1 . . . . A 430 ILE CD1 . 36430 1 566 . 1 . 1 48 48 ILE N N 15 127.866 0.300 . 1 . . . . A 430 ILE N . 36430 1 567 . 1 . 1 49 49 LEU H H 1 8.512 0.030 . 1 . . . . A 431 LEU H . 36430 1 568 . 1 . 1 49 49 LEU HA H 1 4.548 0.030 . 1 . . . . A 431 LEU HA . 36430 1 569 . 1 . 1 49 49 LEU HB2 H 1 2.361 0.030 . 2 . . . . A 431 LEU HB2 . 36430 1 570 . 1 . 1 49 49 LEU HB3 H 1 1.803 0.030 . 2 . . . . A 431 LEU HB3 . 36430 1 571 . 1 . 1 49 49 LEU HG H 1 1.742 0.030 . 1 . . . . A 431 LEU HG . 36430 1 572 . 1 . 1 49 49 LEU HD11 H 1 0.994 0.030 . 2 . . . . A 431 LEU HD11 . 36430 1 573 . 1 . 1 49 49 LEU HD12 H 1 0.994 0.030 . 2 . . . . A 431 LEU HD12 . 36430 1 574 . 1 . 1 49 49 LEU HD13 H 1 0.994 0.030 . 2 . . . . A 431 LEU HD13 . 36430 1 575 . 1 . 1 49 49 LEU HD21 H 1 0.886 0.030 . 2 . . . . A 431 LEU HD21 . 36430 1 576 . 1 . 1 49 49 LEU HD22 H 1 0.886 0.030 . 2 . . . . A 431 LEU HD22 . 36430 1 577 . 1 . 1 49 49 LEU HD23 H 1 0.886 0.030 . 2 . . . . A 431 LEU HD23 . 36430 1 578 . 1 . 1 49 49 LEU C C 13 176.784 0.300 . 1 . . . . A 431 LEU C . 36430 1 579 . 1 . 1 49 49 LEU CA C 13 55.734 0.300 . 1 . . . . A 431 LEU CA . 36430 1 580 . 1 . 1 49 49 LEU CB C 13 40.834 0.300 . 1 . . . . A 431 LEU CB . 36430 1 581 . 1 . 1 49 49 LEU CG C 13 27.984 0.300 . 1 . . . . A 431 LEU CG . 36430 1 582 . 1 . 1 49 49 LEU CD1 C 13 26.309 0.300 . 2 . . . . A 431 LEU CD1 . 36430 1 583 . 1 . 1 49 49 LEU CD2 C 13 22.774 0.300 . 2 . . . . A 431 LEU CD2 . 36430 1 584 . 1 . 1 49 49 LEU N N 15 128.273 0.300 . 1 . . . . A 431 LEU N . 36430 1 585 . 1 . 1 50 50 ASN H H 1 8.677 0.030 . 1 . . . . A 432 ASN H . 36430 1 586 . 1 . 1 50 50 ASN HA H 1 4.761 0.030 . 1 . . . . A 432 ASN HA . 36430 1 587 . 1 . 1 50 50 ASN HB2 H 1 2.859 0.030 . 2 . . . . A 432 ASN HB2 . 36430 1 588 . 1 . 1 50 50 ASN HB3 H 1 2.811 0.030 . 2 . . . . A 432 ASN HB3 . 36430 1 589 . 1 . 1 50 50 ASN HD21 H 1 7.706 0.030 . 2 . . . . A 432 ASN HD21 . 36430 1 590 . 1 . 1 50 50 ASN HD22 H 1 7.033 0.030 . 2 . . . . A 432 ASN HD22 . 36430 1 591 . 1 . 1 50 50 ASN C C 13 176.796 0.300 . 1 . . . . A 432 ASN C . 36430 1 592 . 1 . 1 50 50 ASN CA C 13 53.135 0.300 . 1 . . . . A 432 ASN CA . 36430 1 593 . 1 . 1 50 50 ASN CB C 13 40.198 0.300 . 1 . . . . A 432 ASN CB . 36430 1 594 . 1 . 1 50 50 ASN N N 15 118.002 0.300 . 1 . . . . A 432 ASN N . 36430 1 595 . 1 . 1 50 50 ASN ND2 N 15 113.850 0.300 . 1 . . . . A 432 ASN ND2 . 36430 1 596 . 1 . 1 51 51 LYS HA H 1 4.195 0.030 . 1 . . . . A 433 LYS HA . 36430 1 597 . 1 . 1 51 51 LYS HB2 H 1 1.940 0.030 . 2 . . . . A 433 LYS HB2 . 36430 1 598 . 1 . 1 51 51 LYS HB3 H 1 1.891 0.030 . 2 . . . . A 433 LYS HB3 . 36430 1 599 . 1 . 1 51 51 LYS HG2 H 1 1.510 0.030 . 2 . . . . A 433 LYS HG2 . 36430 1 600 . 1 . 1 51 51 LYS HG3 H 1 1.430 0.030 . 2 . . . . A 433 LYS HG3 . 36430 1 601 . 1 . 1 51 51 LYS HD2 H 1 1.694 0.030 . 1 . . . . A 433 LYS HD2 . 36430 1 602 . 1 . 1 51 51 LYS HD3 H 1 1.694 0.030 . 1 . . . . A 433 LYS HD3 . 36430 1 603 . 1 . 1 51 51 LYS HE2 H 1 2.981 0.030 . 1 . . . . A 433 LYS HE2 . 36430 1 604 . 1 . 1 51 51 LYS HE3 H 1 2.981 0.030 . 1 . . . . A 433 LYS HE3 . 36430 1 605 . 1 . 1 51 51 LYS C C 13 175.969 0.300 . 1 . . . . A 433 LYS C . 36430 1 606 . 1 . 1 51 51 LYS CA C 13 57.999 0.300 . 1 . . . . A 433 LYS CA . 36430 1 607 . 1 . 1 51 51 LYS CB C 13 33.118 0.300 . 1 . . . . A 433 LYS CB . 36430 1 608 . 1 . 1 51 51 LYS CG C 13 25.341 0.300 . 1 . . . . A 433 LYS CG . 36430 1 609 . 1 . 1 51 51 LYS CD C 13 28.984 0.300 . 1 . . . . A 433 LYS CD . 36430 1 610 . 1 . 1 51 51 LYS CE C 13 42.040 0.300 . 1 . . . . A 433 LYS CE . 36430 1 611 . 1 . 1 52 52 ILE H H 1 7.297 0.030 . 1 . . . . A 434 ILE H . 36430 1 612 . 1 . 1 52 52 ILE HA H 1 4.301 0.030 . 1 . . . . A 434 ILE HA . 36430 1 613 . 1 . 1 52 52 ILE HB H 1 1.830 0.030 . 1 . . . . A 434 ILE HB . 36430 1 614 . 1 . 1 52 52 ILE HG12 H 1 1.322 0.030 . 2 . . . . A 434 ILE HG12 . 36430 1 615 . 1 . 1 52 52 ILE HG13 H 1 1.108 0.030 . 2 . . . . A 434 ILE HG13 . 36430 1 616 . 1 . 1 52 52 ILE HG21 H 1 0.873 0.030 . 1 . . . . A 434 ILE HG21 . 36430 1 617 . 1 . 1 52 52 ILE HG22 H 1 0.873 0.030 . 1 . . . . A 434 ILE HG22 . 36430 1 618 . 1 . 1 52 52 ILE HG23 H 1 0.873 0.030 . 1 . . . . A 434 ILE HG23 . 36430 1 619 . 1 . 1 52 52 ILE HD11 H 1 0.860 0.030 . 1 . . . . A 434 ILE HD11 . 36430 1 620 . 1 . 1 52 52 ILE HD12 H 1 0.860 0.030 . 1 . . . . A 434 ILE HD12 . 36430 1 621 . 1 . 1 52 52 ILE HD13 H 1 0.860 0.030 . 1 . . . . A 434 ILE HD13 . 36430 1 622 . 1 . 1 52 52 ILE C C 13 174.990 0.300 . 1 . . . . A 434 ILE C . 36430 1 623 . 1 . 1 52 52 ILE CA C 13 59.529 0.300 . 1 . . . . A 434 ILE CA . 36430 1 624 . 1 . 1 52 52 ILE CB C 13 40.816 0.300 . 1 . . . . A 434 ILE CB . 36430 1 625 . 1 . 1 52 52 ILE CG1 C 13 26.888 0.300 . 1 . . . . A 434 ILE CG1 . 36430 1 626 . 1 . 1 52 52 ILE CG2 C 13 17.985 0.300 . 1 . . . . A 434 ILE CG2 . 36430 1 627 . 1 . 1 52 52 ILE CD1 C 13 13.196 0.300 . 1 . . . . A 434 ILE CD1 . 36430 1 628 . 1 . 1 52 52 ILE N N 15 114.389 0.300 . 1 . . . . A 434 ILE N . 36430 1 629 . 1 . 1 53 53 ASN H H 1 8.510 0.030 . 1 . . . . A 435 ASN H . 36430 1 630 . 1 . 1 53 53 ASN HA H 1 4.205 0.030 . 1 . . . . A 435 ASN HA . 36430 1 631 . 1 . 1 53 53 ASN HB2 H 1 2.377 0.030 . 2 . . . . A 435 ASN HB2 . 36430 1 632 . 1 . 1 53 53 ASN HB3 H 1 1.856 0.030 . 2 . . . . A 435 ASN HB3 . 36430 1 633 . 1 . 1 53 53 ASN HD21 H 1 7.382 0.030 . 2 . . . . A 435 ASN HD21 . 36430 1 634 . 1 . 1 53 53 ASN HD22 H 1 6.811 0.030 . 2 . . . . A 435 ASN HD22 . 36430 1 635 . 1 . 1 53 53 ASN C C 13 172.967 0.300 . 1 . . . . A 435 ASN C . 36430 1 636 . 1 . 1 53 53 ASN CA C 13 52.121 0.300 . 1 . . . . A 435 ASN CA . 36430 1 637 . 1 . 1 53 53 ASN CB C 13 34.727 0.300 . 1 . . . . A 435 ASN CB . 36430 1 638 . 1 . 1 53 53 ASN N N 15 123.890 0.300 . 1 . . . . A 435 ASN N . 36430 1 639 . 1 . 1 53 53 ASN ND2 N 15 112.772 0.300 . 1 . . . . A 435 ASN ND2 . 36430 1 640 . 1 . 1 54 54 GLU H H 1 7.656 0.030 . 1 . . . . A 436 GLU H . 36430 1 641 . 1 . 1 54 54 GLU HA H 1 5.120 0.030 . 1 . . . . A 436 GLU HA . 36430 1 642 . 1 . 1 54 54 GLU HB2 H 1 1.896 0.030 . 2 . . . . A 436 GLU HB2 . 36430 1 643 . 1 . 1 54 54 GLU HB3 H 1 1.713 0.030 . 2 . . . . A 436 GLU HB3 . 36430 1 644 . 1 . 1 54 54 GLU HG2 H 1 2.124 0.030 . 1 . . . . A 436 GLU HG2 . 36430 1 645 . 1 . 1 54 54 GLU HG3 H 1 2.124 0.030 . 1 . . . . A 436 GLU HG3 . 36430 1 646 . 1 . 1 54 54 GLU C C 13 173.935 0.300 . 1 . . . . A 436 GLU C . 36430 1 647 . 1 . 1 54 54 GLU CA C 13 54.522 0.300 . 1 . . . . A 436 GLU CA . 36430 1 648 . 1 . 1 54 54 GLU CB C 13 35.507 0.300 . 1 . . . . A 436 GLU CB . 36430 1 649 . 1 . 1 54 54 GLU CG C 13 36.857 0.300 . 1 . . . . A 436 GLU CG . 36430 1 650 . 1 . 1 54 54 GLU N N 15 117.056 0.300 . 1 . . . . A 436 GLU N . 36430 1 651 . 1 . 1 55 55 ALA H H 1 9.167 0.030 . 1 . . . . A 437 ALA H . 36430 1 652 . 1 . 1 55 55 ALA HA H 1 5.295 0.030 . 1 . . . . A 437 ALA HA . 36430 1 653 . 1 . 1 55 55 ALA HB1 H 1 1.329 0.030 . 1 . . . . A 437 ALA HB1 . 36430 1 654 . 1 . 1 55 55 ALA HB2 H 1 1.329 0.030 . 1 . . . . A 437 ALA HB2 . 36430 1 655 . 1 . 1 55 55 ALA HB3 H 1 1.329 0.030 . 1 . . . . A 437 ALA HB3 . 36430 1 656 . 1 . 1 55 55 ALA C C 13 174.171 0.300 . 1 . . . . A 437 ALA C . 36430 1 657 . 1 . 1 55 55 ALA CA C 13 50.139 0.300 . 1 . . . . A 437 ALA CA . 36430 1 658 . 1 . 1 55 55 ALA CB C 13 24.954 0.300 . 1 . . . . A 437 ALA CB . 36430 1 659 . 1 . 1 55 55 ALA N N 15 120.619 0.300 . 1 . . . . A 437 ALA N . 36430 1 660 . 1 . 1 56 56 PHE H H 1 9.263 0.030 . 1 . . . . A 438 PHE H . 36430 1 661 . 1 . 1 56 56 PHE HA H 1 5.319 0.030 . 1 . . . . A 438 PHE HA . 36430 1 662 . 1 . 1 56 56 PHE HB2 H 1 2.694 0.030 . 1 . . . . A 438 PHE HB2 . 36430 1 663 . 1 . 1 56 56 PHE HB3 H 1 2.694 0.030 . 1 . . . . A 438 PHE HB3 . 36430 1 664 . 1 . 1 56 56 PHE HD1 H 1 6.889 0.030 . 1 . . . . A 438 PHE HD1 . 36430 1 665 . 1 . 1 56 56 PHE HD2 H 1 6.889 0.030 . 1 . . . . A 438 PHE HD2 . 36430 1 666 . 1 . 1 56 56 PHE HE1 H 1 6.762 0.030 . 1 . . . . A 438 PHE HE1 . 36430 1 667 . 1 . 1 56 56 PHE HE2 H 1 6.762 0.030 . 1 . . . . A 438 PHE HE2 . 36430 1 668 . 1 . 1 56 56 PHE HZ H 1 7.040 0.030 . 1 . . . . A 438 PHE HZ . 36430 1 669 . 1 . 1 56 56 PHE C C 13 175.005 0.300 . 1 . . . . A 438 PHE C . 36430 1 670 . 1 . 1 56 56 PHE CA C 13 56.464 0.300 . 1 . . . . A 438 PHE CA . 36430 1 671 . 1 . 1 56 56 PHE CB C 13 41.829 0.300 . 1 . . . . A 438 PHE CB . 36430 1 672 . 1 . 1 56 56 PHE CD1 C 13 131.020 0.300 . 1 . . . . A 438 PHE CD1 . 36430 1 673 . 1 . 1 56 56 PHE CD2 C 13 131.020 0.300 . 1 . . . . A 438 PHE CD2 . 36430 1 674 . 1 . 1 56 56 PHE CE1 C 13 130.991 0.300 . 1 . . . . A 438 PHE CE1 . 36430 1 675 . 1 . 1 56 56 PHE CE2 C 13 130.991 0.300 . 1 . . . . A 438 PHE CE2 . 36430 1 676 . 1 . 1 56 56 PHE CZ C 13 129.704 0.300 . 1 . . . . A 438 PHE CZ . 36430 1 677 . 1 . 1 56 56 PHE N N 15 118.548 0.300 . 1 . . . . A 438 PHE N . 36430 1 678 . 1 . 1 57 57 ILE H H 1 9.793 0.030 . 1 . . . . A 439 ILE H . 36430 1 679 . 1 . 1 57 57 ILE HA H 1 4.498 0.030 . 1 . . . . A 439 ILE HA . 36430 1 680 . 1 . 1 57 57 ILE HB H 1 1.829 0.030 . 1 . . . . A 439 ILE HB . 36430 1 681 . 1 . 1 57 57 ILE HG12 H 1 1.394 0.030 . 2 . . . . A 439 ILE HG12 . 36430 1 682 . 1 . 1 57 57 ILE HG13 H 1 0.959 0.030 . 2 . . . . A 439 ILE HG13 . 36430 1 683 . 1 . 1 57 57 ILE HG21 H 1 0.970 0.030 . 1 . . . . A 439 ILE HG21 . 36430 1 684 . 1 . 1 57 57 ILE HG22 H 1 0.970 0.030 . 1 . . . . A 439 ILE HG22 . 36430 1 685 . 1 . 1 57 57 ILE HG23 H 1 0.970 0.030 . 1 . . . . A 439 ILE HG23 . 36430 1 686 . 1 . 1 57 57 ILE HD11 H 1 0.632 0.030 . 1 . . . . A 439 ILE HD11 . 36430 1 687 . 1 . 1 57 57 ILE HD12 H 1 0.632 0.030 . 1 . . . . A 439 ILE HD12 . 36430 1 688 . 1 . 1 57 57 ILE HD13 H 1 0.632 0.030 . 1 . . . . A 439 ILE HD13 . 36430 1 689 . 1 . 1 57 57 ILE C C 13 173.699 0.300 . 1 . . . . A 439 ILE C . 36430 1 690 . 1 . 1 57 57 ILE CA C 13 60.972 0.300 . 1 . . . . A 439 ILE CA . 36430 1 691 . 1 . 1 57 57 ILE CB C 13 40.121 0.300 . 1 . . . . A 439 ILE CB . 36430 1 692 . 1 . 1 57 57 ILE CG1 C 13 27.354 0.300 . 1 . . . . A 439 ILE CG1 . 36430 1 693 . 1 . 1 57 57 ILE CG2 C 13 20.014 0.300 . 1 . . . . A 439 ILE CG2 . 36430 1 694 . 1 . 1 57 57 ILE CD1 C 13 14.478 0.300 . 1 . . . . A 439 ILE CD1 . 36430 1 695 . 1 . 1 57 57 ILE N N 15 125.175 0.300 . 1 . . . . A 439 ILE N . 36430 1 696 . 1 . 1 58 58 GLU H H 1 8.985 0.030 . 1 . . . . A 440 GLU H . 36430 1 697 . 1 . 1 58 58 GLU HA H 1 4.656 0.030 . 1 . . . . A 440 GLU HA . 36430 1 698 . 1 . 1 58 58 GLU HB2 H 1 2.066 0.030 . 2 . . . . A 440 GLU HB2 . 36430 1 699 . 1 . 1 58 58 GLU HB3 H 1 1.754 0.030 . 2 . . . . A 440 GLU HB3 . 36430 1 700 . 1 . 1 58 58 GLU HG2 H 1 2.215 0.030 . 2 . . . . A 440 GLU HG2 . 36430 1 701 . 1 . 1 58 58 GLU HG3 H 1 1.969 0.030 . 2 . . . . A 440 GLU HG3 . 36430 1 702 . 1 . 1 58 58 GLU C C 13 174.825 0.300 . 1 . . . . A 440 GLU C . 36430 1 703 . 1 . 1 58 58 GLU CA C 13 55.522 0.300 . 1 . . . . A 440 GLU CA . 36430 1 704 . 1 . 1 58 58 GLU CB C 13 32.172 0.300 . 1 . . . . A 440 GLU CB . 36430 1 705 . 1 . 1 58 58 GLU CG C 13 36.977 0.300 . 1 . . . . A 440 GLU CG . 36430 1 706 . 1 . 1 58 58 GLU N N 15 130.046 0.300 . 1 . . . . A 440 GLU N . 36430 1 707 . 1 . 1 59 59 MET H H 1 8.922 0.030 . 1 . . . . A 441 MET H . 36430 1 708 . 1 . 1 59 59 MET HA H 1 5.330 0.030 . 1 . . . . A 441 MET HA . 36430 1 709 . 1 . 1 59 59 MET HB2 H 1 2.673 0.030 . 2 . . . . A 441 MET HB2 . 36430 1 710 . 1 . 1 59 59 MET HB3 H 1 2.159 0.030 . 2 . . . . A 441 MET HB3 . 36430 1 711 . 1 . 1 59 59 MET HG2 H 1 2.593 0.030 . 2 . . . . A 441 MET HG2 . 36430 1 712 . 1 . 1 59 59 MET HG3 H 1 2.262 0.030 . 2 . . . . A 441 MET HG3 . 36430 1 713 . 1 . 1 59 59 MET HE1 H 1 1.770 0.030 . 1 . . . . A 441 MET HE1 . 36430 1 714 . 1 . 1 59 59 MET HE2 H 1 1.770 0.030 . 1 . . . . A 441 MET HE2 . 36430 1 715 . 1 . 1 59 59 MET HE3 H 1 1.770 0.030 . 1 . . . . A 441 MET HE3 . 36430 1 716 . 1 . 1 59 59 MET C C 13 176.910 0.300 . 1 . . . . A 441 MET C . 36430 1 717 . 1 . 1 59 59 MET CA C 13 52.940 0.300 . 1 . . . . A 441 MET CA . 36430 1 718 . 1 . 1 59 59 MET CB C 13 31.575 0.300 . 1 . . . . A 441 MET CB . 36430 1 719 . 1 . 1 59 59 MET CG C 13 32.952 0.300 . 1 . . . . A 441 MET CG . 36430 1 720 . 1 . 1 59 59 MET CE C 13 16.314 0.300 . 1 . . . . A 441 MET CE . 36430 1 721 . 1 . 1 59 59 MET N N 15 126.064 0.300 . 1 . . . . A 441 MET N . 36430 1 722 . 1 . 1 60 60 ALA H H 1 8.715 0.030 . 1 . . . . A 442 ALA H . 36430 1 723 . 1 . 1 60 60 ALA HA H 1 4.090 0.030 . 1 . . . . A 442 ALA HA . 36430 1 724 . 1 . 1 60 60 ALA HB1 H 1 1.509 0.030 . 1 . . . . A 442 ALA HB1 . 36430 1 725 . 1 . 1 60 60 ALA HB2 H 1 1.509 0.030 . 1 . . . . A 442 ALA HB2 . 36430 1 726 . 1 . 1 60 60 ALA HB3 H 1 1.509 0.030 . 1 . . . . A 442 ALA HB3 . 36430 1 727 . 1 . 1 60 60 ALA C C 13 178.601 0.300 . 1 . . . . A 442 ALA C . 36430 1 728 . 1 . 1 60 60 ALA CA C 13 55.324 0.300 . 1 . . . . A 442 ALA CA . 36430 1 729 . 1 . 1 60 60 ALA CB C 13 18.972 0.300 . 1 . . . . A 442 ALA CB . 36430 1 730 . 1 . 1 60 60 ALA N N 15 122.281 0.300 . 1 . . . . A 442 ALA N . 36430 1 731 . 1 . 1 61 61 THR H H 1 8.020 0.030 . 1 . . . . A 443 THR H . 36430 1 732 . 1 . 1 61 61 THR HA H 1 4.831 0.030 . 1 . . . . A 443 THR HA . 36430 1 733 . 1 . 1 61 61 THR HB H 1 4.620 0.030 . 1 . . . . A 443 THR HB . 36430 1 734 . 1 . 1 61 61 THR HG21 H 1 1.230 0.030 . 1 . . . . A 443 THR HG21 . 36430 1 735 . 1 . 1 61 61 THR HG22 H 1 1.230 0.030 . 1 . . . . A 443 THR HG22 . 36430 1 736 . 1 . 1 61 61 THR HG23 H 1 1.230 0.030 . 1 . . . . A 443 THR HG23 . 36430 1 737 . 1 . 1 61 61 THR C C 13 174.470 0.300 . 1 . . . . A 443 THR C . 36430 1 738 . 1 . 1 61 61 THR CA C 13 58.983 0.300 . 1 . . . . A 443 THR CA . 36430 1 739 . 1 . 1 61 61 THR CB C 13 73.175 0.300 . 1 . . . . A 443 THR CB . 36430 1 740 . 1 . 1 61 61 THR CG2 C 13 21.608 0.300 . 1 . . . . A 443 THR CG2 . 36430 1 741 . 1 . 1 61 61 THR N N 15 103.265 0.300 . 1 . . . . A 443 THR N . 36430 1 742 . 1 . 1 62 62 THR H H 1 8.950 0.030 . 1 . . . . A 444 THR H . 36430 1 743 . 1 . 1 62 62 THR HA H 1 4.316 0.030 . 1 . . . . A 444 THR HA . 36430 1 744 . 1 . 1 62 62 THR HB H 1 3.899 0.030 . 1 . . . . A 444 THR HB . 36430 1 745 . 1 . 1 62 62 THR HG1 H 1 5.617 0.030 . 1 . . . . A 444 THR HG1 . 36430 1 746 . 1 . 1 62 62 THR HG21 H 1 1.241 0.030 . 1 . . . . A 444 THR HG21 . 36430 1 747 . 1 . 1 62 62 THR HG22 H 1 1.241 0.030 . 1 . . . . A 444 THR HG22 . 36430 1 748 . 1 . 1 62 62 THR HG23 H 1 1.241 0.030 . 1 . . . . A 444 THR HG23 . 36430 1 749 . 1 . 1 62 62 THR C C 13 175.548 0.300 . 1 . . . . A 444 THR C . 36430 1 750 . 1 . 1 62 62 THR CA C 13 63.991 0.300 . 1 . . . . A 444 THR CA . 36430 1 751 . 1 . 1 62 62 THR CB C 13 68.934 0.300 . 1 . . . . A 444 THR CB . 36430 1 752 . 1 . 1 62 62 THR CG2 C 13 20.014 0.300 . 1 . . . . A 444 THR CG2 . 36430 1 753 . 1 . 1 62 62 THR N N 15 117.211 0.300 . 1 . . . . A 444 THR N . 36430 1 754 . 1 . 1 63 63 GLU H H 1 9.203 0.030 . 1 . . . . A 445 GLU H . 36430 1 755 . 1 . 1 63 63 GLU HA H 1 3.893 0.030 . 1 . . . . A 445 GLU HA . 36430 1 756 . 1 . 1 63 63 GLU HB2 H 1 2.103 0.030 . 2 . . . . A 445 GLU HB2 . 36430 1 757 . 1 . 1 63 63 GLU HB3 H 1 1.951 0.030 . 2 . . . . A 445 GLU HB3 . 36430 1 758 . 1 . 1 63 63 GLU HG2 H 1 2.598 0.030 . 2 . . . . A 445 GLU HG2 . 36430 1 759 . 1 . 1 63 63 GLU HG3 H 1 2.256 0.030 . 2 . . . . A 445 GLU HG3 . 36430 1 760 . 1 . 1 63 63 GLU C C 13 179.350 0.300 . 1 . . . . A 445 GLU C . 36430 1 761 . 1 . 1 63 63 GLU CA C 13 61.453 0.300 . 1 . . . . A 445 GLU CA . 36430 1 762 . 1 . 1 63 63 GLU CB C 13 27.967 0.300 . 1 . . . . A 445 GLU CB . 36430 1 763 . 1 . 1 63 63 GLU CG C 13 37.451 0.300 . 1 . . . . A 445 GLU CG . 36430 1 764 . 1 . 1 63 63 GLU N N 15 123.707 0.300 . 1 . . . . A 445 GLU N . 36430 1 765 . 1 . 1 64 64 ASP H H 1 7.699 0.030 . 1 . . . . A 446 ASP H . 36430 1 766 . 1 . 1 64 64 ASP HA H 1 4.502 0.030 . 1 . . . . A 446 ASP HA . 36430 1 767 . 1 . 1 64 64 ASP HB2 H 1 2.848 0.030 . 2 . . . . A 446 ASP HB2 . 36430 1 768 . 1 . 1 64 64 ASP HB3 H 1 2.662 0.030 . 2 . . . . A 446 ASP HB3 . 36430 1 769 . 1 . 1 64 64 ASP C C 13 177.351 0.300 . 1 . . . . A 446 ASP C . 36430 1 770 . 1 . 1 64 64 ASP CA C 13 57.113 0.300 . 1 . . . . A 446 ASP CA . 36430 1 771 . 1 . 1 64 64 ASP CB C 13 41.045 0.300 . 1 . . . . A 446 ASP CB . 36430 1 772 . 1 . 1 64 64 ASP N N 15 121.515 0.300 . 1 . . . . A 446 ASP N . 36430 1 773 . 1 . 1 65 65 ALA H H 1 7.192 0.030 . 1 . . . . A 447 ALA H . 36430 1 774 . 1 . 1 65 65 ALA HA H 1 3.823 0.030 . 1 . . . . A 447 ALA HA . 36430 1 775 . 1 . 1 65 65 ALA HB1 H 1 1.331 0.030 . 1 . . . . A 447 ALA HB1 . 36430 1 776 . 1 . 1 65 65 ALA HB2 H 1 1.331 0.030 . 1 . . . . A 447 ALA HB2 . 36430 1 777 . 1 . 1 65 65 ALA HB3 H 1 1.331 0.030 . 1 . . . . A 447 ALA HB3 . 36430 1 778 . 1 . 1 65 65 ALA C C 13 178.727 0.300 . 1 . . . . A 447 ALA C . 36430 1 779 . 1 . 1 65 65 ALA CA C 13 55.539 0.300 . 1 . . . . A 447 ALA CA . 36430 1 780 . 1 . 1 65 65 ALA CB C 13 17.996 0.300 . 1 . . . . A 447 ALA CB . 36430 1 781 . 1 . 1 65 65 ALA N N 15 120.967 0.300 . 1 . . . . A 447 ALA N . 36430 1 782 . 1 . 1 66 66 GLN H H 1 8.759 0.030 . 1 . . . . A 448 GLN H . 36430 1 783 . 1 . 1 66 66 GLN HA H 1 3.759 0.030 . 1 . . . . A 448 GLN HA . 36430 1 784 . 1 . 1 66 66 GLN HB2 H 1 2.121 0.030 . 2 . . . . A 448 GLN HB2 . 36430 1 785 . 1 . 1 66 66 GLN HB3 H 1 2.039 0.030 . 2 . . . . A 448 GLN HB3 . 36430 1 786 . 1 . 1 66 66 GLN HG2 H 1 2.500 0.030 . 2 . . . . A 448 GLN HG2 . 36430 1 787 . 1 . 1 66 66 GLN HG3 H 1 2.210 0.030 . 2 . . . . A 448 GLN HG3 . 36430 1 788 . 1 . 1 66 66 GLN HE21 H 1 6.961 0.030 . 2 . . . . A 448 GLN HE21 . 36430 1 789 . 1 . 1 66 66 GLN HE22 H 1 7.703 0.030 . 2 . . . . A 448 GLN HE22 . 36430 1 790 . 1 . 1 66 66 GLN C C 13 177.909 0.300 . 1 . . . . A 448 GLN C . 36430 1 791 . 1 . 1 66 66 GLN CA C 13 58.842 0.300 . 1 . . . . A 448 GLN CA . 36430 1 792 . 1 . 1 66 66 GLN CB C 13 29.832 0.300 . 1 . . . . A 448 GLN CB . 36430 1 793 . 1 . 1 66 66 GLN CG C 13 34.864 0.300 . 1 . . . . A 448 GLN CG . 36430 1 794 . 1 . 1 66 66 GLN N N 15 115.309 0.300 . 1 . . . . A 448 GLN N . 36430 1 795 . 1 . 1 66 66 GLN NE2 N 15 115.763 0.300 . 1 . . . . A 448 GLN NE2 . 36430 1 796 . 1 . 1 67 67 ALA H H 1 7.973 0.030 . 1 . . . . A 449 ALA H . 36430 1 797 . 1 . 1 67 67 ALA HA H 1 4.083 0.030 . 1 . . . . A 449 ALA HA . 36430 1 798 . 1 . 1 67 67 ALA HB1 H 1 1.683 0.030 . 1 . . . . A 449 ALA HB1 . 36430 1 799 . 1 . 1 67 67 ALA HB2 H 1 1.683 0.030 . 1 . . . . A 449 ALA HB2 . 36430 1 800 . 1 . 1 67 67 ALA HB3 H 1 1.683 0.030 . 1 . . . . A 449 ALA HB3 . 36430 1 801 . 1 . 1 67 67 ALA C C 13 180.238 0.300 . 1 . . . . A 449 ALA C . 36430 1 802 . 1 . 1 67 67 ALA CA C 13 55.275 0.300 . 1 . . . . A 449 ALA CA . 36430 1 803 . 1 . 1 67 67 ALA CB C 13 18.334 0.300 . 1 . . . . A 449 ALA CB . 36430 1 804 . 1 . 1 67 67 ALA N N 15 121.172 0.300 . 1 . . . . A 449 ALA N . 36430 1 805 . 1 . 1 68 68 ALA H H 1 7.522 0.030 . 1 . . . . A 450 ALA H . 36430 1 806 . 1 . 1 68 68 ALA HA H 1 2.283 0.030 . 1 . . . . A 450 ALA HA . 36430 1 807 . 1 . 1 68 68 ALA HB1 H 1 1.159 0.030 . 1 . . . . A 450 ALA HB1 . 36430 1 808 . 1 . 1 68 68 ALA HB2 H 1 1.159 0.030 . 1 . . . . A 450 ALA HB2 . 36430 1 809 . 1 . 1 68 68 ALA HB3 H 1 1.159 0.030 . 1 . . . . A 450 ALA HB3 . 36430 1 810 . 1 . 1 68 68 ALA C C 13 177.870 0.300 . 1 . . . . A 450 ALA C . 36430 1 811 . 1 . 1 68 68 ALA CA C 13 54.184 0.300 . 1 . . . . A 450 ALA CA . 36430 1 812 . 1 . 1 68 68 ALA CB C 13 18.064 0.300 . 1 . . . . A 450 ALA CB . 36430 1 813 . 1 . 1 68 68 ALA N N 15 121.375 0.300 . 1 . . . . A 450 ALA N . 36430 1 814 . 1 . 1 69 69 VAL H H 1 7.742 0.030 . 1 . . . . A 451 VAL H . 36430 1 815 . 1 . 1 69 69 VAL HA H 1 3.361 0.030 . 1 . . . . A 451 VAL HA . 36430 1 816 . 1 . 1 69 69 VAL HB H 1 2.018 0.030 . 1 . . . . A 451 VAL HB . 36430 1 817 . 1 . 1 69 69 VAL HG11 H 1 0.918 0.030 . 2 . . . . A 451 VAL HG11 . 36430 1 818 . 1 . 1 69 69 VAL HG12 H 1 0.918 0.030 . 2 . . . . A 451 VAL HG12 . 36430 1 819 . 1 . 1 69 69 VAL HG13 H 1 0.918 0.030 . 2 . . . . A 451 VAL HG13 . 36430 1 820 . 1 . 1 69 69 VAL HG21 H 1 1.002 0.030 . 2 . . . . A 451 VAL HG21 . 36430 1 821 . 1 . 1 69 69 VAL HG22 H 1 1.002 0.030 . 2 . . . . A 451 VAL HG22 . 36430 1 822 . 1 . 1 69 69 VAL HG23 H 1 1.002 0.030 . 2 . . . . A 451 VAL HG23 . 36430 1 823 . 1 . 1 69 69 VAL C C 13 179.286 0.300 . 1 . . . . A 451 VAL C . 36430 1 824 . 1 . 1 69 69 VAL CA C 13 67.117 0.300 . 1 . . . . A 451 VAL CA . 36430 1 825 . 1 . 1 69 69 VAL CB C 13 31.528 0.300 . 1 . . . . A 451 VAL CB . 36430 1 826 . 1 . 1 69 69 VAL CG1 C 13 23.697 0.300 . 2 . . . . A 451 VAL CG1 . 36430 1 827 . 1 . 1 69 69 VAL CG2 C 13 21.305 0.300 . 2 . . . . A 451 VAL CG2 . 36430 1 828 . 1 . 1 69 69 VAL N N 15 115.897 0.300 . 1 . . . . A 451 VAL N . 36430 1 829 . 1 . 1 70 70 ASP H H 1 8.804 0.030 . 1 . . . . A 452 ASP H . 36430 1 830 . 1 . 1 70 70 ASP HA H 1 4.357 0.030 . 1 . . . . A 452 ASP HA . 36430 1 831 . 1 . 1 70 70 ASP HB2 H 1 2.751 0.030 . 2 . . . . A 452 ASP HB2 . 36430 1 832 . 1 . 1 70 70 ASP HB3 H 1 2.590 0.030 . 2 . . . . A 452 ASP HB3 . 36430 1 833 . 1 . 1 70 70 ASP C C 13 179.829 0.300 . 1 . . . . A 452 ASP C . 36430 1 834 . 1 . 1 70 70 ASP CA C 13 57.540 0.300 . 1 . . . . A 452 ASP CA . 36430 1 835 . 1 . 1 70 70 ASP CB C 13 40.516 0.300 . 1 . . . . A 452 ASP CB . 36430 1 836 . 1 . 1 70 70 ASP N N 15 120.487 0.300 . 1 . . . . A 452 ASP N . 36430 1 837 . 1 . 1 71 71 TYR H H 1 7.923 0.030 . 1 . . . . A 453 TYR H . 36430 1 838 . 1 . 1 71 71 TYR HA H 1 4.012 0.030 . 1 . . . . A 453 TYR HA . 36430 1 839 . 1 . 1 71 71 TYR HB2 H 1 2.875 0.030 . 2 . . . . A 453 TYR HB2 . 36430 1 840 . 1 . 1 71 71 TYR HB3 H 1 2.483 0.030 . 2 . . . . A 453 TYR HB3 . 36430 1 841 . 1 . 1 71 71 TYR HD1 H 1 6.179 0.030 . 1 . . . . A 453 TYR HD1 . 36430 1 842 . 1 . 1 71 71 TYR HD2 H 1 6.179 0.030 . 1 . . . . A 453 TYR HD2 . 36430 1 843 . 1 . 1 71 71 TYR HE1 H 1 6.670 0.030 . 1 . . . . A 453 TYR HE1 . 36430 1 844 . 1 . 1 71 71 TYR HE2 H 1 6.670 0.030 . 1 . . . . A 453 TYR HE2 . 36430 1 845 . 1 . 1 71 71 TYR C C 13 178.618 0.300 . 1 . . . . A 453 TYR C . 36430 1 846 . 1 . 1 71 71 TYR CA C 13 62.251 0.300 . 1 . . . . A 453 TYR CA . 36430 1 847 . 1 . 1 71 71 TYR CB C 13 38.716 0.300 . 1 . . . . A 453 TYR CB . 36430 1 848 . 1 . 1 71 71 TYR CD1 C 13 133.485 0.300 . 1 . . . . A 453 TYR CD1 . 36430 1 849 . 1 . 1 71 71 TYR CD2 C 13 133.485 0.300 . 1 . . . . A 453 TYR CD2 . 36430 1 850 . 1 . 1 71 71 TYR CE1 C 13 117.945 0.300 . 1 . . . . A 453 TYR CE1 . 36430 1 851 . 1 . 1 71 71 TYR CE2 C 13 117.945 0.300 . 1 . . . . A 453 TYR CE2 . 36430 1 852 . 1 . 1 71 71 TYR N N 15 123.067 0.300 . 1 . . . . A 453 TYR N . 36430 1 853 . 1 . 1 72 72 TYR H H 1 7.551 0.030 . 1 . . . . A 454 TYR H . 36430 1 854 . 1 . 1 72 72 TYR HA H 1 5.379 0.030 . 1 . . . . A 454 TYR HA . 36430 1 855 . 1 . 1 72 72 TYR HB2 H 1 3.628 0.030 . 2 . . . . A 454 TYR HB2 . 36430 1 856 . 1 . 1 72 72 TYR HB3 H 1 2.592 0.030 . 2 . . . . A 454 TYR HB3 . 36430 1 857 . 1 . 1 72 72 TYR HD1 H 1 7.363 0.030 . 1 . . . . A 454 TYR HD1 . 36430 1 858 . 1 . 1 72 72 TYR HD2 H 1 7.363 0.030 . 1 . . . . A 454 TYR HD2 . 36430 1 859 . 1 . 1 72 72 TYR C C 13 175.674 0.300 . 1 . . . . A 454 TYR C . 36430 1 860 . 1 . 1 72 72 TYR CA C 13 59.878 0.300 . 1 . . . . A 454 TYR CA . 36430 1 861 . 1 . 1 72 72 TYR CB C 13 37.150 0.300 . 1 . . . . A 454 TYR CB . 36430 1 862 . 1 . 1 72 72 TYR N N 15 116.189 0.300 . 1 . . . . A 454 TYR N . 36430 1 863 . 1 . 1 73 73 THR H H 1 7.718 0.030 . 1 . . . . A 455 THR H . 36430 1 864 . 1 . 1 73 73 THR HA H 1 4.318 0.030 . 1 . . . . A 455 THR HA . 36430 1 865 . 1 . 1 73 73 THR HB H 1 4.401 0.030 . 1 . . . . A 455 THR HB . 36430 1 866 . 1 . 1 73 73 THR HG1 H 1 5.696 0.030 . 1 . . . . A 455 THR HG1 . 36430 1 867 . 1 . 1 73 73 THR HG21 H 1 1.398 0.030 . 1 . . . . A 455 THR HG21 . 36430 1 868 . 1 . 1 73 73 THR HG22 H 1 1.398 0.030 . 1 . . . . A 455 THR HG22 . 36430 1 869 . 1 . 1 73 73 THR HG23 H 1 1.398 0.030 . 1 . . . . A 455 THR HG23 . 36430 1 870 . 1 . 1 73 73 THR C C 13 176.209 0.300 . 1 . . . . A 455 THR C . 36430 1 871 . 1 . 1 73 73 THR CA C 13 65.290 0.300 . 1 . . . . A 455 THR CA . 36430 1 872 . 1 . 1 73 73 THR CB C 13 69.495 0.300 . 1 . . . . A 455 THR CB . 36430 1 873 . 1 . 1 73 73 THR CG2 C 13 21.553 0.300 . 1 . . . . A 455 THR CG2 . 36430 1 874 . 1 . 1 73 73 THR N N 15 113.258 0.300 . 1 . . . . A 455 THR N . 36430 1 875 . 1 . 1 74 74 THR H H 1 7.197 0.030 . 1 . . . . A 456 THR H . 36430 1 876 . 1 . 1 74 74 THR HA H 1 4.427 0.030 . 1 . . . . A 456 THR HA . 36430 1 877 . 1 . 1 74 74 THR HB H 1 4.276 0.030 . 1 . . . . A 456 THR HB . 36430 1 878 . 1 . 1 74 74 THR HG21 H 1 1.141 0.030 . 1 . . . . A 456 THR HG21 . 36430 1 879 . 1 . 1 74 74 THR HG22 H 1 1.141 0.030 . 1 . . . . A 456 THR HG22 . 36430 1 880 . 1 . 1 74 74 THR HG23 H 1 1.141 0.030 . 1 . . . . A 456 THR HG23 . 36430 1 881 . 1 . 1 74 74 THR C C 13 174.053 0.300 . 1 . . . . A 456 THR C . 36430 1 882 . 1 . 1 74 74 THR CA C 13 62.040 0.300 . 1 . . . . A 456 THR CA . 36430 1 883 . 1 . 1 74 74 THR CB C 13 70.132 0.300 . 1 . . . . A 456 THR CB . 36430 1 884 . 1 . 1 74 74 THR CG2 C 13 21.808 0.300 . 1 . . . . A 456 THR CG2 . 36430 1 885 . 1 . 1 74 74 THR N N 15 109.727 0.300 . 1 . . . . A 456 THR N . 36430 1 886 . 1 . 1 75 75 THR H H 1 7.357 0.030 . 1 . . . . A 457 THR H . 36430 1 887 . 1 . 1 75 75 THR HA H 1 4.627 0.030 . 1 . . . . A 457 THR HA . 36430 1 888 . 1 . 1 75 75 THR HB H 1 3.344 0.030 . 1 . . . . A 457 THR HB . 36430 1 889 . 1 . 1 75 75 THR HG1 H 1 5.375 0.030 . 1 . . . . A 457 THR HG1 . 36430 1 890 . 1 . 1 75 75 THR HG21 H 1 1.069 0.030 . 1 . . . . A 457 THR HG21 . 36430 1 891 . 1 . 1 75 75 THR HG22 H 1 1.069 0.030 . 1 . . . . A 457 THR HG22 . 36430 1 892 . 1 . 1 75 75 THR HG23 H 1 1.069 0.030 . 1 . . . . A 457 THR HG23 . 36430 1 893 . 1 . 1 75 75 THR C C 13 170.701 0.300 . 1 . . . . A 457 THR C . 36430 1 894 . 1 . 1 75 75 THR CA C 13 60.009 0.300 . 1 . . . . A 457 THR CA . 36430 1 895 . 1 . 1 75 75 THR CB C 13 71.181 0.300 . 1 . . . . A 457 THR CB . 36430 1 896 . 1 . 1 75 75 THR CG2 C 13 20.309 0.300 . 1 . . . . A 457 THR CG2 . 36430 1 897 . 1 . 1 75 75 THR N N 15 121.370 0.300 . 1 . . . . A 457 THR N . 36430 1 898 . 1 . 1 76 76 PRO HA H 1 4.440 0.030 . 1 . . . . A 458 PRO HA . 36430 1 899 . 1 . 1 76 76 PRO HB2 H 1 2.231 0.030 . 2 . . . . A 458 PRO HB2 . 36430 1 900 . 1 . 1 76 76 PRO HB3 H 1 1.696 0.030 . 2 . . . . A 458 PRO HB3 . 36430 1 901 . 1 . 1 76 76 PRO HG2 H 1 2.043 0.030 . 2 . . . . A 458 PRO HG2 . 36430 1 902 . 1 . 1 76 76 PRO HG3 H 1 1.929 0.030 . 2 . . . . A 458 PRO HG3 . 36430 1 903 . 1 . 1 76 76 PRO HD2 H 1 3.785 0.030 . 2 . . . . A 458 PRO HD2 . 36430 1 904 . 1 . 1 76 76 PRO HD3 H 1 3.687 0.030 . 2 . . . . A 458 PRO HD3 . 36430 1 905 . 1 . 1 76 76 PRO C C 13 176.410 0.300 . 1 . . . . A 458 PRO C . 36430 1 906 . 1 . 1 76 76 PRO CA C 13 63.476 0.300 . 1 . . . . A 458 PRO CA . 36430 1 907 . 1 . 1 76 76 PRO CB C 13 32.321 0.300 . 1 . . . . A 458 PRO CB . 36430 1 908 . 1 . 1 76 76 PRO CG C 13 27.588 0.300 . 1 . . . . A 458 PRO CG . 36430 1 909 . 1 . 1 76 76 PRO CD C 13 51.120 0.300 . 1 . . . . A 458 PRO CD . 36430 1 910 . 1 . 1 77 77 ALA H H 1 8.950 0.030 . 1 . . . . A 459 ALA H . 36430 1 911 . 1 . 1 77 77 ALA HA H 1 4.215 0.030 . 1 . . . . A 459 ALA HA . 36430 1 912 . 1 . 1 77 77 ALA HB1 H 1 0.661 0.030 . 1 . . . . A 459 ALA HB1 . 36430 1 913 . 1 . 1 77 77 ALA HB2 H 1 0.661 0.030 . 1 . . . . A 459 ALA HB2 . 36430 1 914 . 1 . 1 77 77 ALA HB3 H 1 0.661 0.030 . 1 . . . . A 459 ALA HB3 . 36430 1 915 . 1 . 1 77 77 ALA C C 13 175.462 0.300 . 1 . . . . A 459 ALA C . 36430 1 916 . 1 . 1 77 77 ALA CA C 13 51.067 0.300 . 1 . . . . A 459 ALA CA . 36430 1 917 . 1 . 1 77 77 ALA CB C 13 19.746 0.300 . 1 . . . . A 459 ALA CB . 36430 1 918 . 1 . 1 77 77 ALA N N 15 128.204 0.300 . 1 . . . . A 459 ALA N . 36430 1 919 . 1 . 1 78 78 LEU H H 1 7.993 0.030 . 1 . . . . A 460 LEU H . 36430 1 920 . 1 . 1 78 78 LEU HA H 1 4.918 0.030 . 1 . . . . A 460 LEU HA . 36430 1 921 . 1 . 1 78 78 LEU HB2 H 1 1.741 0.030 . 2 . . . . A 460 LEU HB2 . 36430 1 922 . 1 . 1 78 78 LEU HB3 H 1 0.742 0.030 . 2 . . . . A 460 LEU HB3 . 36430 1 923 . 1 . 1 78 78 LEU HG H 1 1.429 0.030 . 1 . . . . A 460 LEU HG . 36430 1 924 . 1 . 1 78 78 LEU HD11 H 1 0.801 0.030 . 2 . . . . A 460 LEU HD11 . 36430 1 925 . 1 . 1 78 78 LEU HD12 H 1 0.801 0.030 . 2 . . . . A 460 LEU HD12 . 36430 1 926 . 1 . 1 78 78 LEU HD13 H 1 0.801 0.030 . 2 . . . . A 460 LEU HD13 . 36430 1 927 . 1 . 1 78 78 LEU HD21 H 1 0.489 0.030 . 2 . . . . A 460 LEU HD21 . 36430 1 928 . 1 . 1 78 78 LEU HD22 H 1 0.489 0.030 . 2 . . . . A 460 LEU HD22 . 36430 1 929 . 1 . 1 78 78 LEU HD23 H 1 0.489 0.030 . 2 . . . . A 460 LEU HD23 . 36430 1 930 . 1 . 1 78 78 LEU C C 13 176.375 0.300 . 1 . . . . A 460 LEU C . 36430 1 931 . 1 . 1 78 78 LEU CA C 13 53.294 0.300 . 1 . . . . A 460 LEU CA . 36430 1 932 . 1 . 1 78 78 LEU CB C 13 44.677 0.300 . 1 . . . . A 460 LEU CB . 36430 1 933 . 1 . 1 78 78 LEU CG C 13 26.572 0.300 . 1 . . . . A 460 LEU CG . 36430 1 934 . 1 . 1 78 78 LEU CD1 C 13 25.636 0.300 . 2 . . . . A 460 LEU CD1 . 36430 1 935 . 1 . 1 78 78 LEU CD2 C 13 22.478 0.300 . 2 . . . . A 460 LEU CD2 . 36430 1 936 . 1 . 1 78 78 LEU N N 15 121.642 0.300 . 1 . . . . A 460 LEU N . 36430 1 937 . 1 . 1 79 79 VAL H H 1 8.815 0.030 . 1 . . . . A 461 VAL H . 36430 1 938 . 1 . 1 79 79 VAL HA H 1 3.918 0.030 . 1 . . . . A 461 VAL HA . 36430 1 939 . 1 . 1 79 79 VAL HB H 1 1.825 0.030 . 1 . . . . A 461 VAL HB . 36430 1 940 . 1 . 1 79 79 VAL HG11 H 1 0.579 0.030 . 2 . . . . A 461 VAL HG11 . 36430 1 941 . 1 . 1 79 79 VAL HG12 H 1 0.579 0.030 . 2 . . . . A 461 VAL HG12 . 36430 1 942 . 1 . 1 79 79 VAL HG13 H 1 0.579 0.030 . 2 . . . . A 461 VAL HG13 . 36430 1 943 . 1 . 1 79 79 VAL HG21 H 1 0.413 0.030 . 2 . . . . A 461 VAL HG21 . 36430 1 944 . 1 . 1 79 79 VAL HG22 H 1 0.413 0.030 . 2 . . . . A 461 VAL HG22 . 36430 1 945 . 1 . 1 79 79 VAL HG23 H 1 0.413 0.030 . 2 . . . . A 461 VAL HG23 . 36430 1 946 . 1 . 1 79 79 VAL C C 13 176.941 0.300 . 1 . . . . A 461 VAL C . 36430 1 947 . 1 . 1 79 79 VAL CA C 13 61.989 0.300 . 1 . . . . A 461 VAL CA . 36430 1 948 . 1 . 1 79 79 VAL CB C 13 33.615 0.300 . 1 . . . . A 461 VAL CB . 36430 1 949 . 1 . 1 79 79 VAL CG1 C 13 23.602 0.300 . 2 . . . . A 461 VAL CG1 . 36430 1 950 . 1 . 1 79 79 VAL CG2 C 13 21.110 0.300 . 2 . . . . A 461 VAL CG2 . 36430 1 951 . 1 . 1 79 79 VAL N N 15 120.907 0.300 . 1 . . . . A 461 VAL N . 36430 1 952 . 1 . 1 80 80 PHE H H 1 9.212 0.030 . 1 . . . . A 462 PHE H . 36430 1 953 . 1 . 1 80 80 PHE HA H 1 4.397 0.030 . 1 . . . . A 462 PHE HA . 36430 1 954 . 1 . 1 80 80 PHE HB2 H 1 3.405 0.030 . 2 . . . . A 462 PHE HB2 . 36430 1 955 . 1 . 1 80 80 PHE HB3 H 1 3.131 0.030 . 2 . . . . A 462 PHE HB3 . 36430 1 956 . 1 . 1 80 80 PHE HD1 H 1 7.166 0.030 . 1 . . . . A 462 PHE HD1 . 36430 1 957 . 1 . 1 80 80 PHE HD2 H 1 7.166 0.030 . 1 . . . . A 462 PHE HD2 . 36430 1 958 . 1 . 1 80 80 PHE HE1 H 1 7.308 0.030 . 1 . . . . A 462 PHE HE1 . 36430 1 959 . 1 . 1 80 80 PHE HE2 H 1 7.308 0.030 . 1 . . . . A 462 PHE HE2 . 36430 1 960 . 1 . 1 80 80 PHE HZ H 1 6.730 0.030 . 1 . . . . A 462 PHE HZ . 36430 1 961 . 1 . 1 80 80 PHE C C 13 176.382 0.300 . 1 . . . . A 462 PHE C . 36430 1 962 . 1 . 1 80 80 PHE CA C 13 59.109 0.300 . 1 . . . . A 462 PHE CA . 36430 1 963 . 1 . 1 80 80 PHE CB C 13 36.610 0.300 . 1 . . . . A 462 PHE CB . 36430 1 964 . 1 . 1 80 80 PHE CD1 C 13 131.933 0.300 . 1 . . . . A 462 PHE CD1 . 36430 1 965 . 1 . 1 80 80 PHE CD2 C 13 131.933 0.300 . 1 . . . . A 462 PHE CD2 . 36430 1 966 . 1 . 1 80 80 PHE CE1 C 13 131.619 0.300 . 1 . . . . A 462 PHE CE1 . 36430 1 967 . 1 . 1 80 80 PHE CE2 C 13 131.619 0.300 . 1 . . . . A 462 PHE CE2 . 36430 1 968 . 1 . 1 80 80 PHE CZ C 13 128.395 0.300 . 1 . . . . A 462 PHE CZ . 36430 1 969 . 1 . 1 80 80 PHE N N 15 127.015 0.300 . 1 . . . . A 462 PHE N . 36430 1 970 . 1 . 1 81 81 GLY H H 1 8.649 0.030 . 1 . . . . A 463 GLY H . 36430 1 971 . 1 . 1 81 81 GLY HA2 H 1 4.171 0.030 . 2 . . . . A 463 GLY HA2 . 36430 1 972 . 1 . 1 81 81 GLY HA3 H 1 3.547 0.030 . 2 . . . . A 463 GLY HA3 . 36430 1 973 . 1 . 1 81 81 GLY C C 13 173.376 0.300 . 1 . . . . A 463 GLY C . 36430 1 974 . 1 . 1 81 81 GLY CA C 13 45.712 0.300 . 1 . . . . A 463 GLY CA . 36430 1 975 . 1 . 1 81 81 GLY N N 15 101.928 0.300 . 1 . . . . A 463 GLY N . 36430 1 976 . 1 . 1 82 82 LYS H H 1 7.743 0.030 . 1 . . . . A 464 LYS H . 36430 1 977 . 1 . 1 82 82 LYS HA H 1 4.961 0.030 . 1 . . . . A 464 LYS HA . 36430 1 978 . 1 . 1 82 82 LYS HB2 H 1 1.930 0.030 . 2 . . . . A 464 LYS HB2 . 36430 1 979 . 1 . 1 82 82 LYS HB3 H 1 1.769 0.030 . 2 . . . . A 464 LYS HB3 . 36430 1 980 . 1 . 1 82 82 LYS HG2 H 1 1.539 0.030 . 2 . . . . A 464 LYS HG2 . 36430 1 981 . 1 . 1 82 82 LYS HG3 H 1 1.461 0.030 . 2 . . . . A 464 LYS HG3 . 36430 1 982 . 1 . 1 82 82 LYS HD2 H 1 1.761 0.030 . 2 . . . . A 464 LYS HD2 . 36430 1 983 . 1 . 1 82 82 LYS HD3 H 1 1.671 0.030 . 2 . . . . A 464 LYS HD3 . 36430 1 984 . 1 . 1 82 82 LYS HE2 H 1 3.057 0.030 . 1 . . . . A 464 LYS HE2 . 36430 1 985 . 1 . 1 82 82 LYS HE3 H 1 3.057 0.030 . 1 . . . . A 464 LYS HE3 . 36430 1 986 . 1 . 1 82 82 LYS C C 13 173.473 0.300 . 1 . . . . A 464 LYS C . 36430 1 987 . 1 . 1 82 82 LYS CA C 13 52.623 0.300 . 1 . . . . A 464 LYS CA . 36430 1 988 . 1 . 1 82 82 LYS CB C 13 34.547 0.300 . 1 . . . . A 464 LYS CB . 36430 1 989 . 1 . 1 82 82 LYS CG C 13 24.673 0.300 . 1 . . . . A 464 LYS CG . 36430 1 990 . 1 . 1 82 82 LYS CD C 13 28.878 0.300 . 1 . . . . A 464 LYS CD . 36430 1 991 . 1 . 1 82 82 LYS CE C 13 42.387 0.300 . 1 . . . . A 464 LYS CE . 36430 1 992 . 1 . 1 82 82 LYS N N 15 121.534 0.300 . 1 . . . . A 464 LYS N . 36430 1 993 . 1 . 1 83 83 PRO HA H 1 5.106 0.030 . 1 . . . . A 465 PRO HA . 36430 1 994 . 1 . 1 83 83 PRO HB2 H 1 2.169 0.030 . 2 . . . . A 465 PRO HB2 . 36430 1 995 . 1 . 1 83 83 PRO HB3 H 1 1.902 0.030 . 2 . . . . A 465 PRO HB3 . 36430 1 996 . 1 . 1 83 83 PRO HG2 H 1 2.127 0.030 . 2 . . . . A 465 PRO HG2 . 36430 1 997 . 1 . 1 83 83 PRO HG3 H 1 1.943 0.030 . 2 . . . . A 465 PRO HG3 . 36430 1 998 . 1 . 1 83 83 PRO HD2 H 1 3.749 0.030 . 2 . . . . A 465 PRO HD2 . 36430 1 999 . 1 . 1 83 83 PRO HD3 H 1 3.682 0.030 . 2 . . . . A 465 PRO HD3 . 36430 1 1000 . 1 . 1 83 83 PRO C C 13 178.077 0.300 . 1 . . . . A 465 PRO C . 36430 1 1001 . 1 . 1 83 83 PRO CA C 13 62.945 0.300 . 1 . . . . A 465 PRO CA . 36430 1 1002 . 1 . 1 83 83 PRO CB C 13 32.590 0.300 . 1 . . . . A 465 PRO CB . 36430 1 1003 . 1 . 1 83 83 PRO CG C 13 27.658 0.300 . 1 . . . . A 465 PRO CG . 36430 1 1004 . 1 . 1 83 83 PRO CD C 13 50.710 0.300 . 1 . . . . A 465 PRO CD . 36430 1 1005 . 1 . 1 84 84 VAL H H 1 8.341 0.030 . 1 . . . . A 466 VAL H . 36430 1 1006 . 1 . 1 84 84 VAL HA H 1 4.688 0.030 . 1 . . . . A 466 VAL HA . 36430 1 1007 . 1 . 1 84 84 VAL HB H 1 2.392 0.030 . 1 . . . . A 466 VAL HB . 36430 1 1008 . 1 . 1 84 84 VAL HG11 H 1 0.777 0.030 . 2 . . . . A 466 VAL HG11 . 36430 1 1009 . 1 . 1 84 84 VAL HG12 H 1 0.777 0.030 . 2 . . . . A 466 VAL HG12 . 36430 1 1010 . 1 . 1 84 84 VAL HG13 H 1 0.777 0.030 . 2 . . . . A 466 VAL HG13 . 36430 1 1011 . 1 . 1 84 84 VAL HG21 H 1 0.386 0.030 . 2 . . . . A 466 VAL HG21 . 36430 1 1012 . 1 . 1 84 84 VAL HG22 H 1 0.386 0.030 . 2 . . . . A 466 VAL HG22 . 36430 1 1013 . 1 . 1 84 84 VAL HG23 H 1 0.386 0.030 . 2 . . . . A 466 VAL HG23 . 36430 1 1014 . 1 . 1 84 84 VAL C C 13 174.722 0.300 . 1 . . . . A 466 VAL C . 36430 1 1015 . 1 . 1 84 84 VAL CA C 13 58.863 0.300 . 1 . . . . A 466 VAL CA . 36430 1 1016 . 1 . 1 84 84 VAL CB C 13 33.516 0.300 . 1 . . . . A 466 VAL CB . 36430 1 1017 . 1 . 1 84 84 VAL CG1 C 13 22.666 0.300 . 2 . . . . A 466 VAL CG1 . 36430 1 1018 . 1 . 1 84 84 VAL CG2 C 13 18.804 0.300 . 2 . . . . A 466 VAL CG2 . 36430 1 1019 . 1 . 1 84 84 VAL N N 15 115.805 0.300 . 1 . . . . A 466 VAL N . 36430 1 1020 . 1 . 1 85 85 ARG H H 1 7.868 0.030 . 1 . . . . A 467 ARG H . 36430 1 1021 . 1 . 1 85 85 ARG HA H 1 4.526 0.030 . 1 . . . . A 467 ARG HA . 36430 1 1022 . 1 . 1 85 85 ARG HB2 H 1 1.462 0.030 . 2 . . . . A 467 ARG HB2 . 36430 1 1023 . 1 . 1 85 85 ARG HB3 H 1 1.373 0.030 . 2 . . . . A 467 ARG HB3 . 36430 1 1024 . 1 . 1 85 85 ARG HG2 H 1 1.623 0.030 . 1 . . . . A 467 ARG HG2 . 36430 1 1025 . 1 . 1 85 85 ARG HG3 H 1 1.623 0.030 . 1 . . . . A 467 ARG HG3 . 36430 1 1026 . 1 . 1 85 85 ARG HD2 H 1 3.226 0.030 . 2 . . . . A 467 ARG HD2 . 36430 1 1027 . 1 . 1 85 85 ARG HD3 H 1 3.043 0.030 . 2 . . . . A 467 ARG HD3 . 36430 1 1028 . 1 . 1 85 85 ARG C C 13 175.099 0.300 . 1 . . . . A 467 ARG C . 36430 1 1029 . 1 . 1 85 85 ARG CA C 13 55.522 0.300 . 1 . . . . A 467 ARG CA . 36430 1 1030 . 1 . 1 85 85 ARG CB C 13 33.195 0.300 . 1 . . . . A 467 ARG CB . 36430 1 1031 . 1 . 1 85 85 ARG CG C 13 27.389 0.300 . 1 . . . . A 467 ARG CG . 36430 1 1032 . 1 . 1 85 85 ARG CD C 13 43.638 0.300 . 1 . . . . A 467 ARG CD . 36430 1 1033 . 1 . 1 85 85 ARG N N 15 119.485 0.300 . 1 . . . . A 467 ARG N . 36430 1 1034 . 1 . 1 86 86 VAL H H 1 8.201 0.030 . 1 . . . . A 468 VAL H . 36430 1 1035 . 1 . 1 86 86 VAL HA H 1 4.551 0.030 . 1 . . . . A 468 VAL HA . 36430 1 1036 . 1 . 1 86 86 VAL HB H 1 1.916 0.030 . 1 . . . . A 468 VAL HB . 36430 1 1037 . 1 . 1 86 86 VAL HG11 H 1 0.669 0.030 . 2 . . . . A 468 VAL HG11 . 36430 1 1038 . 1 . 1 86 86 VAL HG12 H 1 0.669 0.030 . 2 . . . . A 468 VAL HG12 . 36430 1 1039 . 1 . 1 86 86 VAL HG13 H 1 0.669 0.030 . 2 . . . . A 468 VAL HG13 . 36430 1 1040 . 1 . 1 86 86 VAL HG21 H 1 0.430 0.030 . 2 . . . . A 468 VAL HG21 . 36430 1 1041 . 1 . 1 86 86 VAL HG22 H 1 0.430 0.030 . 2 . . . . A 468 VAL HG22 . 36430 1 1042 . 1 . 1 86 86 VAL HG23 H 1 0.430 0.030 . 2 . . . . A 468 VAL HG23 . 36430 1 1043 . 1 . 1 86 86 VAL C C 13 174.266 0.300 . 1 . . . . A 468 VAL C . 36430 1 1044 . 1 . 1 86 86 VAL CA C 13 61.447 0.300 . 1 . . . . A 468 VAL CA . 36430 1 1045 . 1 . 1 86 86 VAL CB C 13 33.640 0.300 . 1 . . . . A 468 VAL CB . 36430 1 1046 . 1 . 1 86 86 VAL CG1 C 13 21.809 0.300 . 2 . . . . A 468 VAL CG1 . 36430 1 1047 . 1 . 1 86 86 VAL CG2 C 13 20.870 0.300 . 2 . . . . A 468 VAL CG2 . 36430 1 1048 . 1 . 1 86 86 VAL N N 15 121.269 0.300 . 1 . . . . A 468 VAL N . 36430 1 1049 . 1 . 1 87 87 HIS H H 1 9.134 0.030 . 1 . . . . A 469 HIS H . 36430 1 1050 . 1 . 1 87 87 HIS HA H 1 5.092 0.030 . 1 . . . . A 469 HIS HA . 36430 1 1051 . 1 . 1 87 87 HIS HB2 H 1 3.300 0.030 . 2 . . . . A 469 HIS HB2 . 36430 1 1052 . 1 . 1 87 87 HIS HB3 H 1 2.940 0.030 . 2 . . . . A 469 HIS HB3 . 36430 1 1053 . 1 . 1 87 87 HIS HD2 H 1 6.782 0.030 . 1 . . . . A 469 HIS HD2 . 36430 1 1054 . 1 . 1 87 87 HIS HE1 H 1 7.673 0.030 . 1 . . . . A 469 HIS HE1 . 36430 1 1055 . 1 . 1 87 87 HIS C C 13 174.281 0.300 . 1 . . . . A 469 HIS C . 36430 1 1056 . 1 . 1 87 87 HIS CA C 13 53.764 0.300 . 1 . . . . A 469 HIS CA . 36430 1 1057 . 1 . 1 87 87 HIS CB C 13 34.810 0.300 . 1 . . . . A 469 HIS CB . 36430 1 1058 . 1 . 1 87 87 HIS CD2 C 13 120.300 0.300 . 1 . . . . A 469 HIS CD2 . 36430 1 1059 . 1 . 1 87 87 HIS CE1 C 13 138.070 0.300 . 1 . . . . A 469 HIS CE1 . 36430 1 1060 . 1 . 1 87 87 HIS N N 15 124.806 0.300 . 1 . . . . A 469 HIS N . 36430 1 1061 . 1 . 1 88 88 LEU H H 1 8.982 0.030 . 1 . . . . A 470 LEU H . 36430 1 1062 . 1 . 1 88 88 LEU HA H 1 4.853 0.030 . 1 . . . . A 470 LEU HA . 36430 1 1063 . 1 . 1 88 88 LEU HB2 H 1 1.584 0.030 . 2 . . . . A 470 LEU HB2 . 36430 1 1064 . 1 . 1 88 88 LEU HB3 H 1 1.459 0.030 . 2 . . . . A 470 LEU HB3 . 36430 1 1065 . 1 . 1 88 88 LEU HG H 1 1.485 0.030 . 1 . . . . A 470 LEU HG . 36430 1 1066 . 1 . 1 88 88 LEU HD11 H 1 0.781 0.030 . 2 . . . . A 470 LEU HD11 . 36430 1 1067 . 1 . 1 88 88 LEU HD12 H 1 0.781 0.030 . 2 . . . . A 470 LEU HD12 . 36430 1 1068 . 1 . 1 88 88 LEU HD13 H 1 0.781 0.030 . 2 . . . . A 470 LEU HD13 . 36430 1 1069 . 1 . 1 88 88 LEU HD21 H 1 0.720 0.030 . 2 . . . . A 470 LEU HD21 . 36430 1 1070 . 1 . 1 88 88 LEU HD22 H 1 0.720 0.030 . 2 . . . . A 470 LEU HD22 . 36430 1 1071 . 1 . 1 88 88 LEU HD23 H 1 0.720 0.030 . 2 . . . . A 470 LEU HD23 . 36430 1 1072 . 1 . 1 88 88 LEU C C 13 177.406 0.300 . 1 . . . . A 470 LEU C . 36430 1 1073 . 1 . 1 88 88 LEU CA C 13 54.542 0.300 . 1 . . . . A 470 LEU CA . 36430 1 1074 . 1 . 1 88 88 LEU CB C 13 43.066 0.300 . 1 . . . . A 470 LEU CB . 36430 1 1075 . 1 . 1 88 88 LEU CG C 13 27.206 0.300 . 1 . . . . A 470 LEU CG . 36430 1 1076 . 1 . 1 88 88 LEU CD1 C 13 24.316 0.300 . 2 . . . . A 470 LEU CD1 . 36430 1 1077 . 1 . 1 88 88 LEU CD2 C 13 24.982 0.300 . 2 . . . . A 470 LEU CD2 . 36430 1 1078 . 1 . 1 88 88 LEU N N 15 122.886 0.300 . 1 . . . . A 470 LEU N . 36430 1 1079 . 1 . 1 89 89 SER H H 1 9.011 0.030 . 1 . . . . A 471 SER H . 36430 1 1080 . 1 . 1 89 89 SER HA H 1 4.610 0.030 . 1 . . . . A 471 SER HA . 36430 1 1081 . 1 . 1 89 89 SER HB2 H 1 3.901 0.030 . 1 . . . . A 471 SER HB2 . 36430 1 1082 . 1 . 1 89 89 SER HB3 H 1 3.901 0.030 . 1 . . . . A 471 SER HB3 . 36430 1 1083 . 1 . 1 89 89 SER C C 13 174.922 0.300 . 1 . . . . A 471 SER C . 36430 1 1084 . 1 . 1 89 89 SER CA C 13 58.813 0.300 . 1 . . . . A 471 SER CA . 36430 1 1085 . 1 . 1 89 89 SER CB C 13 65.374 0.300 . 1 . . . . A 471 SER CB . 36430 1 1086 . 1 . 1 89 89 SER N N 15 118.214 0.300 . 1 . . . . A 471 SER N . 36430 1 1087 . 1 . 1 90 90 GLN HA H 1 4.467 0.030 . 1 . . . . A 472 GLN HA . 36430 1 1088 . 1 . 1 90 90 GLN HB2 H 1 2.189 0.030 . 2 . . . . A 472 GLN HB2 . 36430 1 1089 . 1 . 1 90 90 GLN HB3 H 1 1.939 0.030 . 2 . . . . A 472 GLN HB3 . 36430 1 1090 . 1 . 1 90 90 GLN HG2 H 1 2.439 0.030 . 2 . . . . A 472 GLN HG2 . 36430 1 1091 . 1 . 1 90 90 GLN HG3 H 1 2.394 0.030 . 2 . . . . A 472 GLN HG3 . 36430 1 1092 . 1 . 1 90 90 GLN HE21 H 1 7.518 0.030 . 2 . . . . A 472 GLN HE21 . 36430 1 1093 . 1 . 1 90 90 GLN HE22 H 1 6.868 0.030 . 2 . . . . A 472 GLN HE22 . 36430 1 1094 . 1 . 1 90 90 GLN CA C 13 56.000 0.300 . 1 . . . . A 472 GLN CA . 36430 1 1095 . 1 . 1 90 90 GLN CB C 13 29.700 0.300 . 1 . . . . A 472 GLN CB . 36430 1 1096 . 1 . 1 90 90 GLN CG C 13 33.602 0.300 . 1 . . . . A 472 GLN CG . 36430 1 1097 . 1 . 1 90 90 GLN NE2 N 15 112.099 0.300 . 1 . . . . A 472 GLN NE2 . 36430 1 1098 . 1 . 1 91 91 LYS HA H 1 3.991 0.030 . 1 . . . . A 473 LYS HA . 36430 1 1099 . 1 . 1 91 91 LYS HB2 H 1 1.485 0.030 . 2 . . . . A 473 LYS HB2 . 36430 1 1100 . 1 . 1 91 91 LYS HB3 H 1 1.358 0.030 . 2 . . . . A 473 LYS HB3 . 36430 1 1101 . 1 . 1 91 91 LYS HG2 H 1 1.133 0.030 . 2 . . . . A 473 LYS HG2 . 36430 1 1102 . 1 . 1 91 91 LYS HG3 H 1 0.897 0.030 . 2 . . . . A 473 LYS HG3 . 36430 1 1103 . 1 . 1 91 91 LYS HD2 H 1 1.492 0.030 . 2 . . . . A 473 LYS HD2 . 36430 1 1104 . 1 . 1 91 91 LYS HD3 H 1 1.430 0.030 . 2 . . . . A 473 LYS HD3 . 36430 1 1105 . 1 . 1 91 91 LYS HE2 H 1 2.816 0.030 . 1 . . . . A 473 LYS HE2 . 36430 1 1106 . 1 . 1 91 91 LYS HE3 H 1 2.816 0.030 . 1 . . . . A 473 LYS HE3 . 36430 1 1107 . 1 . 1 91 91 LYS CA C 13 57.367 0.300 . 1 . . . . A 473 LYS CA . 36430 1 1108 . 1 . 1 91 91 LYS CB C 13 33.560 0.300 . 1 . . . . A 473 LYS CB . 36430 1 1109 . 1 . 1 91 91 LYS CG C 13 24.761 0.300 . 1 . . . . A 473 LYS CG . 36430 1 1110 . 1 . 1 91 91 LYS CD C 13 29.198 0.300 . 1 . . . . A 473 LYS CD . 36430 1 1111 . 1 . 1 91 91 LYS CE C 13 41.882 0.300 . 1 . . . . A 473 LYS CE . 36430 1 1112 . 1 . 1 92 92 TYR H H 1 7.697 0.030 . 1 . . . . A 474 TYR H . 36430 1 1113 . 1 . 1 92 92 TYR HA H 1 4.253 0.030 . 1 . . . . A 474 TYR HA . 36430 1 1114 . 1 . 1 92 92 TYR HB2 H 1 2.498 0.030 . 2 . . . . A 474 TYR HB2 . 36430 1 1115 . 1 . 1 92 92 TYR HB3 H 1 2.066 0.030 . 2 . . . . A 474 TYR HB3 . 36430 1 1116 . 1 . 1 92 92 TYR HD1 H 1 6.601 0.030 . 1 . . . . A 474 TYR HD1 . 36430 1 1117 . 1 . 1 92 92 TYR HD2 H 1 6.601 0.030 . 1 . . . . A 474 TYR HD2 . 36430 1 1118 . 1 . 1 92 92 TYR HE1 H 1 6.430 0.030 . 1 . . . . A 474 TYR HE1 . 36430 1 1119 . 1 . 1 92 92 TYR HE2 H 1 6.430 0.030 . 1 . . . . A 474 TYR HE2 . 36430 1 1120 . 1 . 1 92 92 TYR CB C 13 38.777 0.300 . 1 . . . . A 474 TYR CB . 36430 1 1121 . 1 . 1 92 92 TYR CD1 C 13 132.936 0.300 . 1 . . . . A 474 TYR CD1 . 36430 1 1122 . 1 . 1 92 92 TYR CD2 C 13 132.936 0.300 . 1 . . . . A 474 TYR CD2 . 36430 1 1123 . 1 . 1 92 92 TYR CE1 C 13 117.703 0.300 . 1 . . . . A 474 TYR CE1 . 36430 1 1124 . 1 . 1 92 92 TYR CE2 C 13 117.703 0.300 . 1 . . . . A 474 TYR CE2 . 36430 1 1125 . 1 . 1 92 92 TYR N N 15 119.262 0.300 . 1 . . . . A 474 TYR N . 36430 1 1126 . 1 . 1 93 93 LYS H H 1 7.715 0.030 . 1 . . . . A 475 LYS H . 36430 1 1127 . 1 . 1 93 93 LYS HA H 1 4.129 0.030 . 1 . . . . A 475 LYS HA . 36430 1 1128 . 1 . 1 93 93 LYS HB2 H 1 1.780 0.030 . 2 . . . . A 475 LYS HB2 . 36430 1 1129 . 1 . 1 93 93 LYS HB3 H 1 1.580 0.030 . 2 . . . . A 475 LYS HB3 . 36430 1 1130 . 1 . 1 93 93 LYS HG2 H 1 1.309 0.030 . 2 . . . . A 475 LYS HG2 . 36430 1 1131 . 1 . 1 93 93 LYS HG3 H 1 1.220 0.030 . 2 . . . . A 475 LYS HG3 . 36430 1 1132 . 1 . 1 93 93 LYS HD2 H 1 1.543 0.030 . 1 . . . . A 475 LYS HD2 . 36430 1 1133 . 1 . 1 93 93 LYS HD3 H 1 1.543 0.030 . 1 . . . . A 475 LYS HD3 . 36430 1 1134 . 1 . 1 93 93 LYS HE2 H 1 2.888 0.030 . 1 . . . . A 475 LYS HE2 . 36430 1 1135 . 1 . 1 93 93 LYS HE3 H 1 2.888 0.030 . 1 . . . . A 475 LYS HE3 . 36430 1 1136 . 1 . 1 93 93 LYS CA C 13 57.048 0.300 . 1 . . . . A 475 LYS CA . 36430 1 1137 . 1 . 1 93 93 LYS CB C 13 33.167 0.300 . 1 . . . . A 475 LYS CB . 36430 1 1138 . 1 . 1 93 93 LYS CG C 13 25.206 0.300 . 1 . . . . A 475 LYS CG . 36430 1 1139 . 1 . 1 93 93 LYS CD C 13 29.109 0.300 . 1 . . . . A 475 LYS CD . 36430 1 1140 . 1 . 1 93 93 LYS CE C 13 42.237 0.300 . 1 . . . . A 475 LYS CE . 36430 1 1141 . 1 . 1 93 93 LYS N N 15 118.049 0.300 . 1 . . . . A 475 LYS N . 36430 1 1142 . 1 . 1 94 94 ARG H H 1 7.691 0.030 . 1 . . . . A 476 ARG H . 36430 1 1143 . 1 . 1 94 94 ARG HA H 1 4.123 0.030 . 1 . . . . A 476 ARG HA . 36430 1 1144 . 1 . 1 94 94 ARG HB2 H 1 1.763 0.030 . 2 . . . . A 476 ARG HB2 . 36430 1 1145 . 1 . 1 94 94 ARG HB3 H 1 1.599 0.030 . 2 . . . . A 476 ARG HB3 . 36430 1 1146 . 1 . 1 94 94 ARG HG2 H 1 1.526 0.030 . 2 . . . . A 476 ARG HG2 . 36430 1 1147 . 1 . 1 94 94 ARG HG3 H 1 1.441 0.030 . 2 . . . . A 476 ARG HG3 . 36430 1 1148 . 1 . 1 94 94 ARG HD2 H 1 3.140 0.030 . 1 . . . . A 476 ARG HD2 . 36430 1 1149 . 1 . 1 94 94 ARG HD3 H 1 3.140 0.030 . 1 . . . . A 476 ARG HD3 . 36430 1 1150 . 1 . 1 94 94 ARG C C 13 175.482 0.300 . 1 . . . . A 476 ARG C . 36430 1 1151 . 1 . 1 94 94 ARG CA C 13 54.994 0.300 . 1 . . . . A 476 ARG CA . 36430 1 1152 . 1 . 1 94 94 ARG CB C 13 32.137 0.300 . 1 . . . . A 476 ARG CB . 36430 1 1153 . 1 . 1 94 94 ARG CG C 13 26.907 0.300 . 1 . . . . A 476 ARG CG . 36430 1 1154 . 1 . 1 94 94 ARG CD C 13 43.236 0.300 . 1 . . . . A 476 ARG CD . 36430 1 1155 . 1 . 1 95 95 ILE H H 1 8.405 0.030 . 1 . . . . A 477 ILE H . 36430 1 1156 . 1 . 1 95 95 ILE HA H 1 3.921 0.030 . 1 . . . . A 477 ILE HA . 36430 1 1157 . 1 . 1 95 95 ILE HB H 1 1.643 0.030 . 1 . . . . A 477 ILE HB . 36430 1 1158 . 1 . 1 95 95 ILE HG12 H 1 0.918 0.030 . 2 . . . . A 477 ILE HG12 . 36430 1 1159 . 1 . 1 95 95 ILE HG13 H 1 1.328 0.030 . 2 . . . . A 477 ILE HG13 . 36430 1 1160 . 1 . 1 95 95 ILE HG21 H 1 0.665 0.030 . 1 . . . . A 477 ILE HG21 . 36430 1 1161 . 1 . 1 95 95 ILE HG22 H 1 0.665 0.030 . 1 . . . . A 477 ILE HG22 . 36430 1 1162 . 1 . 1 95 95 ILE HG23 H 1 0.665 0.030 . 1 . . . . A 477 ILE HG23 . 36430 1 1163 . 1 . 1 95 95 ILE HD11 H 1 0.614 0.030 . 1 . . . . A 477 ILE HD11 . 36430 1 1164 . 1 . 1 95 95 ILE HD12 H 1 0.614 0.030 . 1 . . . . A 477 ILE HD12 . 36430 1 1165 . 1 . 1 95 95 ILE HD13 H 1 0.614 0.030 . 1 . . . . A 477 ILE HD13 . 36430 1 1166 . 1 . 1 95 95 ILE C C 13 175.785 0.300 . 1 . . . . A 477 ILE C . 36430 1 1167 . 1 . 1 95 95 ILE CA C 13 61.241 0.300 . 1 . . . . A 477 ILE CA . 36430 1 1168 . 1 . 1 95 95 ILE CB C 13 38.528 0.300 . 1 . . . . A 477 ILE CB . 36430 1 1169 . 1 . 1 95 95 ILE CG1 C 13 27.591 0.300 . 1 . . . . A 477 ILE CG1 . 36430 1 1170 . 1 . 1 95 95 ILE CG2 C 13 17.453 0.300 . 1 . . . . A 477 ILE CG2 . 36430 1 1171 . 1 . 1 95 95 ILE CD1 C 13 13.196 0.300 . 1 . . . . A 477 ILE CD1 . 36430 1 1172 . 1 . 1 95 95 ILE N N 15 121.753 0.300 . 1 . . . . A 477 ILE N . 36430 1 1173 . 1 . 1 96 96 LYS H H 1 8.271 0.030 . 1 . . . . A 478 LYS H . 36430 1 1174 . 1 . 1 96 96 LYS HA H 1 4.267 0.030 . 1 . . . . A 478 LYS HA . 36430 1 1175 . 1 . 1 96 96 LYS HB2 H 1 1.760 0.030 . 2 . . . . A 478 LYS HB2 . 36430 1 1176 . 1 . 1 96 96 LYS HB3 H 1 1.657 0.030 . 2 . . . . A 478 LYS HB3 . 36430 1 1177 . 1 . 1 96 96 LYS HG2 H 1 1.336 0.030 . 1 . . . . A 478 LYS HG2 . 36430 1 1178 . 1 . 1 96 96 LYS HG3 H 1 1.336 0.030 . 1 . . . . A 478 LYS HG3 . 36430 1 1179 . 1 . 1 96 96 LYS HD2 H 1 1.626 0.030 . 1 . . . . A 478 LYS HD2 . 36430 1 1180 . 1 . 1 96 96 LYS HD3 H 1 1.626 0.030 . 1 . . . . A 478 LYS HD3 . 36430 1 1181 . 1 . 1 96 96 LYS HE2 H 1 2.933 0.030 . 1 . . . . A 478 LYS HE2 . 36430 1 1182 . 1 . 1 96 96 LYS HE3 H 1 2.933 0.030 . 1 . . . . A 478 LYS HE3 . 36430 1 1183 . 1 . 1 96 96 LYS C C 13 175.946 0.300 . 1 . . . . A 478 LYS C . 36430 1 1184 . 1 . 1 96 96 LYS CA C 13 56.217 0.300 . 1 . . . . A 478 LYS CA . 36430 1 1185 . 1 . 1 96 96 LYS CB C 13 33.070 0.300 . 1 . . . . A 478 LYS CB . 36430 1 1186 . 1 . 1 96 96 LYS CG C 13 24.673 0.300 . 1 . . . . A 478 LYS CG . 36430 1 1187 . 1 . 1 96 96 LYS CD C 13 29.166 0.300 . 1 . . . . A 478 LYS CD . 36430 1 1188 . 1 . 1 96 96 LYS CE C 13 42.149 0.300 . 1 . . . . A 478 LYS CE . 36430 1 1189 . 1 . 1 96 96 LYS N N 15 125.487 0.300 . 1 . . . . A 478 LYS N . 36430 1 1190 . 1 . 1 97 97 SER HA H 1 4.429 0.030 . 1 . . . . A 479 SER HA . 36430 1 1191 . 1 . 1 97 97 SER HB2 H 1 3.825 0.030 . 1 . . . . A 479 SER HB2 . 36430 1 1192 . 1 . 1 97 97 SER HB3 H 1 3.825 0.030 . 1 . . . . A 479 SER HB3 . 36430 1 1193 . 1 . 1 97 97 SER CA C 13 58.273 0.300 . 1 . . . . A 479 SER CA . 36430 1 1194 . 1 . 1 97 97 SER CB C 13 64.000 0.300 . 1 . . . . A 479 SER CB . 36430 1 1195 . 1 . 1 98 98 GLY H H 1 8.212 0.030 . 1 . . . . A 480 GLY H . 36430 1 1196 . 1 . 1 98 98 GLY HA2 H 1 4.088 0.030 . 1 . . . . A 480 GLY HA2 . 36430 1 1197 . 1 . 1 98 98 GLY HA3 H 1 4.088 0.030 . 1 . . . . A 480 GLY HA3 . 36430 1 1198 . 1 . 1 98 98 GLY CA C 13 44.666 0.300 . 1 . . . . A 480 GLY CA . 36430 1 1199 . 1 . 1 98 98 GLY N N 15 110.588 0.300 . 1 . . . . A 480 GLY N . 36430 1 1200 . 1 . 1 99 99 PRO HA H 1 4.420 0.030 . 1 . . . . A 481 PRO HA . 36430 1 1201 . 1 . 1 99 99 PRO HB2 H 1 2.212 0.030 . 2 . . . . A 481 PRO HB2 . 36430 1 1202 . 1 . 1 99 99 PRO HB3 H 1 1.926 0.030 . 2 . . . . A 481 PRO HB3 . 36430 1 1203 . 1 . 1 99 99 PRO HG2 H 1 1.951 0.030 . 1 . . . . A 481 PRO HG2 . 36430 1 1204 . 1 . 1 99 99 PRO HG3 H 1 1.951 0.030 . 1 . . . . A 481 PRO HG3 . 36430 1 1205 . 1 . 1 99 99 PRO HD2 H 1 3.609 0.030 . 2 . . . . A 481 PRO HD2 . 36430 1 1206 . 1 . 1 99 99 PRO HD3 H 1 3.531 0.030 . 2 . . . . A 481 PRO HD3 . 36430 1 1207 . 1 . 1 99 99 PRO CA C 13 63.309 0.300 . 1 . . . . A 481 PRO CA . 36430 1 1208 . 1 . 1 99 99 PRO CB C 13 32.125 0.300 . 1 . . . . A 481 PRO CB . 36430 1 1209 . 1 . 1 99 99 PRO CG C 13 27.085 0.300 . 1 . . . . A 481 PRO CG . 36430 1 1210 . 1 . 1 99 99 PRO CD C 13 49.761 0.300 . 1 . . . . A 481 PRO CD . 36430 1 stop_ save_